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(1R,8aS)-1-[(E)-5-hydroxy-3-methyl-pent-3-enyl]-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
SpectraBase Compound ID 5qtZAdksVsM
InChI InChI=1S/C21H34O3/c1-15(11-14-22)7-9-17-16(19(23)24-5)8-10-18-20(2,3)12-6-13-21(17,18)4/h8,11,17-18,22H,6-7,9-10,12-14H2,1-5H3/b15-11+/t17-,18?,21+/m0/s1
InChIKey UKHYAHGVSGTPMD-QYHZTASXSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SjgmBwW5Ic
Name (1R,8aS)-1-[(E)-5-hydroxy-3-methyl-pent-3-enyl]-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
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Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-15(11-14-22)7-9-17-16(19(23)24-5)8-10-18-20(2,3)12-6-13-21(17,18)4/h8,11,17-18,22H,6-7,9-10,12-14H2,1-5H3/b15-11+/t17-,18?,21+/m0/s1
InChIKey UKHYAHGVSGTPMD-QYHZTASXSA-N
Molecular Weight 334.500 g/mol
SMILES OC\C=C\(CC[C@]1(C(C(=O)OC)=CCC2[C@@]1(CCCC2(C)C)C)[H])C
SPLASH splash10-00kr-9421000000-39e4c4a601b8e655a83b
Source of Spectrum F-50-11002-8
Synonyms Methyl (1R,8aS)-1-[(E)-5-hydroxy-3-methyl-pent-3-enyl]-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylate Methyl (1R,8aS)-5,5,8a-trimethyl-1-[(E)-3-methyl-5-oxidanyl-pent-3-enyl]-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylate (1R,8aS)-1-[(E)-5-hydroxy-3-methylpent-3-enyl]-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
Wiley ID 789295