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(1R,4R,6R)-4-Benzoyloxy-3-methyl-1-(3-methyl-1,2-butadienyl)-6-(1-methylethenyl)-2-cyclohexen-1-ol
SpectraBase Compound ID 4slckigw3b7
InChI InChI=1S/C22H26O3/c1-15(2)11-12-22(24)14-17(5)20(13-19(22)16(3)4)25-21(23)18-9-7-6-8-10-18/h6-10,12,14,19-20,24H,3,13H2,1-2,4-5H3/t19-,20-,22-/m1/s1
InChIKey QDSTVPHXXCNFED-KCZVDYSFSA-N
Mol Weight 338.45 g/mol
Molecular Formula C22H26O3
Exact Mass 338.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BO5ML7PUmMu
Name (1R,4R,6R)-4-Benzoyloxy-3-methyl-1-(3-methyl-1,2-butadienyl)-6-(1-methylethenyl)-2-cyclohexen-1-ol
CAS Registry Number 121115-19-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O3
InChI InChI=1S/C22H26O3/c1-15(2)11-12-22(24)14-17(5)20(13-19(22)16(3)4)25-21(23)18-9-7-6-8-10-18/h6-10,12,14,19-20,24H,3,13H2,1-2,4-5H3/t19-,20-,22-/m1/s1
InChIKey QDSTVPHXXCNFED-KCZVDYSFSA-N
Molecular Weight 338.447 g/mol
SMILES O[C@@]1(C=C(C)[C@@](C[C@@]1(C(=C)C)[H])(OC(=O)c1ccccc1)[H])C=C=C(C)C
SPLASH splash10-0a4i-0900000000-9264a913001d26942917
Source of Spectrum AJ-61-1209-10
Synonyms (1R,4R,5R)-4-hydroxy-5-isopropenyl-2-methyl-4-(3-methyl-1,2-butadienyl)-2-cyclohexen-1-yl benzoate
Wiley ID 1334134