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2-[(6R)-3-(hydroxymethyl)-6-(1-methylethenyl)-1-cyclohex-2-enyl]-5-pentylbenzene-1,3-diol
SpectraBase Compound ID IiMAMYAU1ok
InChI InChI=1S/C21H30O3/c1-4-5-6-7-15-11-19(23)21(20(24)12-15)18-10-16(13-22)8-9-17(18)14(2)3/h10-12,17-18,22-24H,2,4-9,13H2,1,3H3/t17-,18?/m0/s1
InChIKey ZELUXPWDPVXUEI-ZENAZSQFSA-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 C0sr4Ovvy5f
Name 2-[(6R)-3-(hydroxymethyl)-6-(1-methylethenyl)-1-cyclohex-2-enyl]-5-pentylbenzene-1,3-diol
Alternate Name(s) 2-[(6R)-3-(hydroxymethyl)-6-isopropenyl-cyclohex-2-en-1-yl]-5-pentyl-benzene-1,3-diol 2-[(6R)-3-(hydroxymethyl)-6-prop-1-en-2-yl-cyclohex-2-en-1-yl]-5-pentyl-benzene-1,3-diol 5-Amyl-2-[(6R)-6-isopropenyl-3-methylol-cyclohex-2-en-1-yl]resorcinol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-4-5-6-7-15-11-19(23)21(20(24)12-15)18-10-16(13-22)8-9-17(18)14(2)3/h10-12,17-18,22-24H,2,4-9,13H2,1,3H3/t17-,18?/m0/s1
InChIKey ZELUXPWDPVXUEI-ZENAZSQFSA-N
Molecular Weight 330.468 g/mol
SMILES Oc1c(c(cc(c1)CCCCC)O)C1[C@](C(=C)C)(CCC(=C1)CO)[H]
SPLASH splash10-01px-0494000000-7e36eaa6a7f0045e50a8
Source of Spectrum KC-1976-16-0
Wiley ID 1328255