Monoterpenoids

A diverse, modified class of terpenoids comprising two isoprene units and containing oxygen functionality or missing a methyl group; they have relevance to the pharmaceutical, cosmetic, agricultural, and food industries.

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1 – 15 of 291 results

(1R)-(+)-alpha-Pinene, 98%, 80% ee

CAS: 7785-70-8 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001346 InChI Key: GRWFGVWFFZKLTI-RKDXNWHRSA-N Synonym: +-alpha-pinene,1r,5r-2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,1r-+-alpha-pinene,1r,5r-alpha-pinene,unii-h6cm4twh1w,+-pinene,h6cm4twh1w,1r,5r-2-pinene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl-, 1r,5r,+-pin-2 3-ene PubChem CID: 82227 ChEBI: CHEBI:28261 SMILES: CC1=CC[C@@H]2C[C@H]1C2(C)C

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Specifications

PubChem CID	82227
CAS	7785-70-8
Molecular Weight (g/mol)	136.24
ChEBI	CHEBI:28261
MDL Number	MFCD00001346
SMILES	CC1=CC[C@@H]2C[C@H]1C2(C)C
Synonym	+-alpha-pinene,1r,5r-2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,1r-+-alpha-pinene,1r,5r-alpha-pinene,unii-h6cm4twh1w,+-pinene,h6cm4twh1w,1r,5r-2-pinene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl-, 1r,5r,+-pin-2 3-ene
InChI Key	GRWFGVWFFZKLTI-RKDXNWHRSA-N
Molecular Formula	C10H16

Linalool, 97%

CAS: 78-70-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00008906 InChI Key: CDOSHBSSFJOMGT-UHFFFAOYSA-N Synonym: linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool PubChem CID: 6549 ChEBI: CHEBI:17580 IUPAC Name: 3,7-dimethylocta-1,6-dien-3-ol SMILES: CC(=CCCC(C)(C=C)O)C

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Specifications

PubChem CID	6549
CAS	78-70-6
Molecular Weight (g/mol)	154.253
ChEBI	CHEBI:17580
MDL Number	MFCD00008906
SMILES	CC(=CCCC(C)(C=C)O)C
Synonym	linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool
IUPAC Name	3,7-dimethylocta-1,6-dien-3-ol
InChI Key	CDOSHBSSFJOMGT-UHFFFAOYSA-N
Molecular Formula	C10H18O

1,4-Cineole, 85%

CAS: 470-67-7 Molecular Formula: C₁₀H₁₈O Molecular Weight (g/mol): 154.25 InChI Key: RFFOTVCVTJUTAD-UHFFFAOYSA-N Synonym: 1,4-cineole,isocineole,1,4-cineol,1,4-epoxy-p-menthane,isocineple,1,4-cineole natural,p-menthane, 1,4-epoxy,unii-b55jtu839b,fema no. 3658 PubChem CID: 10106 ChEBI: CHEBI:80788 IUPAC Name: 1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane SMILES: CC(C)C12CCC(O1)(CC2)C

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Specifications

PubChem CID	10106
CAS	470-67-7
Molecular Weight (g/mol)	154.25
ChEBI	CHEBI:80788
SMILES	CC(C)C12CCC(O1)(CC2)C
Synonym	1,4-cineole,isocineole,1,4-cineol,1,4-epoxy-p-menthane,isocineple,1,4-cineole natural,p-menthane, 1,4-epoxy,unii-b55jtu839b,fema no. 3658
IUPAC Name	1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
InChI Key	RFFOTVCVTJUTAD-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₈O

Citronellic acid, 94%

CAS: 502-47-6 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00002728 InChI Key: GJWSUKYXUMVMGX-UHFFFAOYNA-N Synonym: citronellic acid,3,7-dimethyl-6-octenoic acid,rhodinolic acid,citronellate,rhodinic acid,6-octenoic acid, 3,7-dimethyl,fema no. 3142,citronellicacid,callitrol,acmc-20apjr PubChem CID: 10402 ChEBI: CHEBI:80507 IUPAC Name: 3,7-dimethyloct-6-enoic acid SMILES: CC(CCC=C(C)C)CC(O)=O

Pricing and Availability
Specifications

PubChem CID	10402
CAS	502-47-6
Molecular Weight (g/mol)	170.25
ChEBI	CHEBI:80507
MDL Number	MFCD00002728
SMILES	CC(CCC=C(C)C)CC(O)=O
Synonym	citronellic acid,3,7-dimethyl-6-octenoic acid,rhodinolic acid,citronellate,rhodinic acid,6-octenoic acid, 3,7-dimethyl,fema no. 3142,citronellicacid,callitrol,acmc-20apjr
IUPAC Name	3,7-dimethyloct-6-enoic acid
InChI Key	GJWSUKYXUMVMGX-UHFFFAOYNA-N
Molecular Formula	C10H18O2

4-Isopropylbenzyl chloride, 95%

CAS: 2051-18-5 Molecular Formula: C10H13Cl Molecular Weight (g/mol): 168.664 MDL Number: MFCD00018885 InChI Key: CYAKWEQUWJAHLW-UHFFFAOYSA-N Synonym: 4-isopropylbenzyl chloride,1-chloromethyl-4-isopropylbenzene,p-cymene, 7-chloro,p-isopropylbenzyl chloride,7-chloro-p-cymene,4-isopropylbenzylchloride,benzene, 1-chloromethyl-4-1-methylethyl,1-chloromethyl-4-propan-2-yl benzene,p-isopropyl benzyl chloride,benzene, 1-chloromethyl-4-methylethyl PubChem CID: 74916 IUPAC Name: 1-(chloromethyl)-4-propan-2-ylbenzene SMILES: CC(C)C1=CC=C(C=C1)CCl

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Specifications

PubChem CID	74916
CAS	2051-18-5
Molecular Weight (g/mol)	168.664
MDL Number	MFCD00018885
SMILES	CC(C)C1=CC=C(C=C1)CCl
Synonym	4-isopropylbenzyl chloride,1-chloromethyl-4-isopropylbenzene,p-cymene, 7-chloro,p-isopropylbenzyl chloride,7-chloro-p-cymene,4-isopropylbenzylchloride,benzene, 1-chloromethyl-4-1-methylethyl,1-chloromethyl-4-propan-2-yl benzene,p-isopropyl benzyl chloride,benzene, 1-chloromethyl-4-methylethyl
IUPAC Name	1-(chloromethyl)-4-propan-2-ylbenzene
InChI Key	CYAKWEQUWJAHLW-UHFFFAOYSA-N
Molecular Formula	C10H13Cl

cis-4-Isopropylcyclohexanecarboxylic acid, 97%

CAS: 7084-93-7 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD04004145,MFCD01734696,MFCD19706019 InChI Key: YRQKWRUZZCBSIG-UHFFFAOYSA-N Synonym: trans-4-isopropylcyclohexanecarboxylic acid,trans-4-isopropylcyclohexane carboxylic acid,4-isopropylcyclohexanecarboxylic acid,hexahydrocumic acid,isopropyl-cyclohexanecarboxylic acid,cis-4-isopropylcyclohexanecarboxylic acid,p-isopropylhexahydrobenzoic acid,cyclohexanecarboxylic acid, 4-1-methylethyl,cyclohexanecarboxylic acid, 4-isopropyl,cyclohexanecarboxylic acid, 4-1-methylethyl-, trans PubChem CID: 81526 IUPAC Name: 4-propan-2-ylcyclohexane-1-carboxylic acid SMILES: CC(C)C1CCC(CC1)C(O)=O

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Specifications

PubChem CID	81526
CAS	7084-93-7
Molecular Weight (g/mol)	170.25
MDL Number	MFCD04004145,MFCD01734696,MFCD19706019
SMILES	CC(C)C1CCC(CC1)C(O)=O
Synonym	trans-4-isopropylcyclohexanecarboxylic acid,trans-4-isopropylcyclohexane carboxylic acid,4-isopropylcyclohexanecarboxylic acid,hexahydrocumic acid,isopropyl-cyclohexanecarboxylic acid,cis-4-isopropylcyclohexanecarboxylic acid,p-isopropylhexahydrobenzoic acid,cyclohexanecarboxylic acid, 4-1-methylethyl,cyclohexanecarboxylic acid, 4-isopropyl,cyclohexanecarboxylic acid, 4-1-methylethyl-, trans
IUPAC Name	4-propan-2-ylcyclohexane-1-carboxylic acid
InChI Key	YRQKWRUZZCBSIG-UHFFFAOYSA-N
Molecular Formula	C10H18O2

alpha-Terpineol, 96%

CAS: 98-55-5 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00001557 InChI Key: WUOACPNHFRMFPN-UHFFFAOYSA-N Synonym: alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol PubChem CID: 17100 ChEBI: CHEBI:22469 IUPAC Name: 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol SMILES: CC1=CCC(CC1)C(C)(C)O

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Specifications

PubChem CID	17100
CAS	98-55-5
Molecular Weight (g/mol)	154.253
ChEBI	CHEBI:22469
MDL Number	MFCD00001557
SMILES	CC1=CCC(CC1)C(C)(C)O
Synonym	alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol
IUPAC Name	2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
InChI Key	WUOACPNHFRMFPN-UHFFFAOYSA-N
Molecular Formula	C10H18O

(+)-3-Carene

CAS: 498-15-7 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00066417 InChI Key: BQOFWKZOCNGFEC-BDAKNGLRSA-N IUPAC Name: (1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene SMILES: CC1=CC[C@@H]2[C@H](C1)C2(C)C

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Specifications

CAS	498-15-7
Molecular Weight (g/mol)	136.24
MDL Number	MFCD00066417
SMILES	CC1=CC[C@@H]2[C@H](C1)C2(C)C
IUPAC Name	(1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
InChI Key	BQOFWKZOCNGFEC-BDAKNGLRSA-N
Molecular Formula	C10H16

3,5-Di-tert-butyl-o-benzoquinone, 98+%

CAS: 3383-21-9 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00001647 InChI Key: NOUZOVBGCDDMSX-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-o-benzoquinone,3,5-di-tert-butyl-1,2-benzoquinone,3,5-di tert-butyl benzo-1,2-quinone,3,5-cyclohexadiene-1,2-dione, 3,5-bis 1,1-dimethylethyl,3,5-di-tert-butylcyclohexa-3,5-diene-1,2-dione,o-benzoquinone, 3,5-di-tert-butyl,3,5-di-tert-butylbenzo-1,2-quinone,3,5-di-t-butyl-1,2-benzoquinone,3,5-ditert-butylbenzo-1,2-quinone,3,5-bis tert-butyl cyclohexa-3,5-diene-1,2-dione PubChem CID: 76915 IUPAC Name: 3,5-ditert-butylcyclohexa-3,5-diene-1,2-dione SMILES: CC(C)(C)C1=CC(=O)C(=O)C(=C1)C(C)(C)C

Pricing and Availability
Specifications

PubChem CID	76915
CAS	3383-21-9
Molecular Weight (g/mol)	220.312
MDL Number	MFCD00001647
SMILES	CC(C)(C)C1=CC(=O)C(=O)C(=C1)C(C)(C)C
Synonym	3,5-di-tert-butyl-o-benzoquinone,3,5-di-tert-butyl-1,2-benzoquinone,3,5-di tert-butyl benzo-1,2-quinone,3,5-cyclohexadiene-1,2-dione, 3,5-bis 1,1-dimethylethyl,3,5-di-tert-butylcyclohexa-3,5-diene-1,2-dione,o-benzoquinone, 3,5-di-tert-butyl,3,5-di-tert-butylbenzo-1,2-quinone,3,5-di-t-butyl-1,2-benzoquinone,3,5-ditert-butylbenzo-1,2-quinone,3,5-bis tert-butyl cyclohexa-3,5-diene-1,2-dione
IUPAC Name	3,5-ditert-butylcyclohexa-3,5-diene-1,2-dione
InChI Key	NOUZOVBGCDDMSX-UHFFFAOYSA-N
Molecular Formula	C14H20O2

3-(2,2,3-Trimethylnorborn-5-yl)cyclohexyl acrylate

CAS: 903876-45-9 Molecular Formula: C19H30O2 Molecular Weight (g/mol): 290.45 MDL Number: MFCD22380703 InChI Key: CDBRNGRSVNBVLJ-UHFFFAOYNA-N Synonym: 3-5,5,6-trimethylbicyclo 2.2.1 heptan-2-yl cyclohexyl prop-2-enoate

Pricing and Availability
Specifications

CAS	903876-45-9
Molecular Weight (g/mol)	290.45
MDL Number	MFCD22380703
Synonym	3-5,5,6-trimethylbicyclo 2.2.1 heptan-2-yl cyclohexyl prop-2-enoate
InChI Key	CDBRNGRSVNBVLJ-UHFFFAOYNA-N
Molecular Formula	C19H30O2

Tris(trifluoromethylhydroxymethylene-d-camphorato)europium(III)

CAS: 34830-11-0 Molecular Formula: C36H45EuF9O6 Molecular Weight (g/mol): 896.7 MDL Number: MFCD00074803 InChI Key: YXJPWWGLCOPUGI-UFRADDTFSA-N Synonym: eu tfc 3,eu facam 3,europium tris 3-trifluoromethylhydroxymethylene---camphorate,europium tris 3-trifluoromethylhydroxymethylene-+-camphorate,tris 3-trifluoromethylhydroxymethylene-d-camphorato europium iii,tris 3-trifluoroacetyl-d-camphorato europium iii,europium iii tris 3-trifluoromethylhydroxymethylene-d-camphorate PubChem CID: 71310195 IUPAC Name: europium;(2E)-4,7,7-trimethyl-2-(2,2,2-trifluoro-1-hydroxyethylidene)bicyclo[2.2.1]heptan-3-one SMILES: CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.[Eu]

Pricing and Availability
Specifications

PubChem CID	71310195
CAS	34830-11-0
Molecular Weight (g/mol)	896.7
MDL Number	MFCD00074803
SMILES	CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.[Eu]
Synonym	eu tfc 3,eu facam 3,europium tris 3-trifluoromethylhydroxymethylene---camphorate,europium tris 3-trifluoromethylhydroxymethylene-+-camphorate,tris 3-trifluoromethylhydroxymethylene-d-camphorato europium iii,tris 3-trifluoroacetyl-d-camphorato europium iii,europium iii tris 3-trifluoromethylhydroxymethylene-d-camphorate
IUPAC Name	europium;(2E)-4,7,7-trimethyl-2-(2,2,2-trifluoro-1-hydroxyethylidene)bicyclo[2.2.1]heptan-3-one
InChI Key	YXJPWWGLCOPUGI-UFRADDTFSA-N
Molecular Formula	C36H45EuF9O6

(1S)-(+)-Camphor-10-sulfonic acid, 98+%(dry wt.), water <2%

CAS: 3144-16-9 Molecular Formula: C10H15O4S Molecular Weight (g/mol): 231.29 MDL Number: MFCD00064157,MFCD00074827 InChI Key: MIOPJNTWMNEORI-XVKPBYJWSA-M Synonym: 1s,4r-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,d-camphorsulfonic acid,r-camphorsulfonic acid,unii-9tlz01s15l,d-+-10-camphorsulfonic acid,d-+-camphor-10-sulfonic acid,dl-10-camphorsulfonic acid,camphor-10-sulfonic acid,camphersulfosaeure german,d-camphor-10-sulfonic acid PubChem CID: 65617 ChEBI: CHEBI:55403 IUPAC Name: [(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid SMILES: CC1(C)[C@H]2CC[C@]1(CS([O-])(=O)=O)C(=O)C2

Pricing and Availability
Specifications

PubChem CID	65617
CAS	3144-16-9
Molecular Weight (g/mol)	231.29
ChEBI	CHEBI:55403
MDL Number	MFCD00064157,MFCD00074827
SMILES	CC1(C)[C@H]2CC[C@]1(CS([O-])(=O)=O)C(=O)C2
Synonym	1s,4r-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,d-camphorsulfonic acid,r-camphorsulfonic acid,unii-9tlz01s15l,d-+-10-camphorsulfonic acid,d-+-camphor-10-sulfonic acid,dl-10-camphorsulfonic acid,camphor-10-sulfonic acid,camphersulfosaeure german,d-camphor-10-sulfonic acid
IUPAC Name	[(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
InChI Key	MIOPJNTWMNEORI-XVKPBYJWSA-M
Molecular Formula	C10H15O4S

(R)-(-)-Carvone, 98%

CAS: 6485-40-1 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00001578 InChI Key: ULDHMXUKGWMISQ-SECBINFHSA-N Synonym: --carvone,l-carvone,r---carvone,l--carvone,r-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,4r-carvone,levo-carvone,--p-mentha-6,8-dien-2-one,--r-carvone PubChem CID: 439570 ChEBI: CHEBI:15400 SMILES: CC(=C)[C@@H]1CC=C(C)C(=O)C1

Pricing and Availability
Specifications

PubChem CID	439570
CAS	6485-40-1
Molecular Weight (g/mol)	150.22
ChEBI	CHEBI:15400
MDL Number	MFCD00001578
SMILES	CC(=C)[C@@H]1CC=C(C)C(=O)C1
Synonym	--carvone,l-carvone,r---carvone,l--carvone,r-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,4r-carvone,levo-carvone,--p-mentha-6,8-dien-2-one,--r-carvone
InChI Key	ULDHMXUKGWMISQ-SECBINFHSA-N
Molecular Formula	C10H14O

2,6-Di-tert-butyl-p-benzoquinone, 98+%

CAS: 719-22-2 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00001601 InChI Key: RDQSIADLBQFVMY-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-p-benzoquinone,2,6-di-tert-butyl-1,4-benzoquinone,2,6-di-tert-butylcyclohexa-2,5-diene-1,4-dione,2,6-di-tert-butylbenzoquinone,2,6-di-tert-butylquinone,2,6-di-t-butyl-p-benzoquinone,2,5-cyclohexadiene-1,4-dione, 2,6-bis 1,1-dimethylethyl,p-benzoquinone, 2,6-di-tert-butyl,unii-4c9d8l0y0t,2,6-di tert-butyl benzo-1,4-quinone PubChem CID: 12867 IUPAC Name: 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione SMILES: CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C

Pricing and Availability
Specifications

PubChem CID	12867
CAS	719-22-2
Molecular Weight (g/mol)	220.312
MDL Number	MFCD00001601
SMILES	CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C
Synonym	2,6-di-tert-butyl-p-benzoquinone,2,6-di-tert-butyl-1,4-benzoquinone,2,6-di-tert-butylcyclohexa-2,5-diene-1,4-dione,2,6-di-tert-butylbenzoquinone,2,6-di-tert-butylquinone,2,6-di-t-butyl-p-benzoquinone,2,5-cyclohexadiene-1,4-dione, 2,6-bis 1,1-dimethylethyl,p-benzoquinone, 2,6-di-tert-butyl,unii-4c9d8l0y0t,2,6-di tert-butyl benzo-1,4-quinone
IUPAC Name	2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione
InChI Key	RDQSIADLBQFVMY-UHFFFAOYSA-N
Molecular Formula	C14H20O2

(S)-cis-Verbenol, 97%, sum of isomers

CAS: 18881-04-4 Molecular Formula: C₁₀H₁₆O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00065444 InChI Key: WONIGEXYPVIKFS-YIZRAAEISA-N Synonym: s-cis-verbenol,verbenol, s-cis,unii-xr9t57f48t,cis-verbenol,bicyclo 3.1.1 hept-3-en-2-ol, 4,6,6-trimethyl-, 1s,2s,5s,1s-cis-verbenol,ccris 5289,?-cis-verbenol PubChem CID: 87839 IUPAC Name: (1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol SMILES: CC1=CC(C2CC1C2(C)C)O

Pricing and Availability
Specifications

PubChem CID	87839
CAS	18881-04-4
Molecular Weight (g/mol)	152.24
MDL Number	MFCD00065444
SMILES	CC1=CC(C2CC1C2(C)C)O
Synonym	s-cis-verbenol,verbenol, s-cis,unii-xr9t57f48t,cis-verbenol,bicyclo 3.1.1 hept-3-en-2-ol, 4,6,6-trimethyl-, 1s,2s,5s,1s-cis-verbenol,ccris 5289,?-cis-verbenol
IUPAC Name	(1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol
InChI Key	WONIGEXYPVIKFS-YIZRAAEISA-N
Molecular Formula	C₁₀H₁₆O

Monoterpenoids

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