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1,3-Benzenediol, 2-[4-hydroxy-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl -, [1R-(1.alpha.,4.beta.,6.beta.)]-
SpectraBase Compound ID KcZovejdcz0
InChI InChI=1S/C21H30O3/c1-5-6-7-8-15-10-19(23)21(20(24)11-15)17-9-14(4)18(22)12-16(17)13(2)3/h9-11,16-18,22-24H,2,5-8,12H2,1,3-4H3/t16-,17+,18+/m0/s1
InChIKey YYLPAYRRVSQJRR-RCCFBDPRSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhlPnTIOOvH
Name 1,3-Benzenediol, 2-[4-hydroxy-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl -, [1R-(1.alpha.,4.beta.,6.beta.)]-
CAS Registry Number 58940-28-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-5-6-7-8-15-10-19(23)21(20(24)11-15)17-9-14(4)18(22)12-16(17)13(2)3/h9-11,16-18,22-24H,2,5-8,12H2,1,3-4H3/t16-,17+,18+/m0/s1
InChIKey YYLPAYRRVSQJRR-RCCFBDPRSA-N
Molecular Weight 330.468 g/mol
SMILES Oc1c(c(cc(c1)CCCCC)O)[C@@]1(C=C(C)[C@@](C[C@]1(C(=C)C)[H])(O)[H])[H]
SPLASH splash10-03di-0093000000-71a696e015e6352abca2
Source of Spectrum KC-1976-14-0
Synonyms 2-[(1R,4R,6R)-4-hydroxy-6-isopropenyl-3-methyl-2-cyclohexen-1-yl]-5-pentyl-1,3-benzenediol 6.alpha.-hydroxycannabidiol 2-[(1R,4R,6R)-4-hydroxy-3-methyl-6-(1-methylethenyl)-1-cyclohex-2-enyl]-5-pentylbenzene-1,3-diol 2-[(1R,4R,6R)-4-hydroxy-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol 2-[(1R,4R,6R)-4-hydroxy-6-isopropenyl-3-methyl-cyclohex-2-en-1-yl]-5-pentyl-benzene-1,3-diol 2-[(1R,4R,6R)-3-methyl-4-oxidanyl-6-prop-1-en-2-yl-cyclohex-2-en-1-yl]-5-pentyl-benzene-1,3-diol
Wiley ID 1328253