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Methyl labda-8(17),13Z-dien-15-oate
SpectraBase Compound ID KPyHMxQ64pN
InChI InChI=1S/C21H34O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,17-18H,2,7-13H2,1,3-6H3/b15-14-/t17-,18-,21+/m0/s1
InChIKey KYTKOCVFNCZSSC-IWTYRFFRSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAyypJjl3Tu
Name Methyl labda-8(17),13Z-dien-15-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,17-18H,2,7-13H2,1,3-6H3/b15-14-/t17-,18-,21+/m0/s1
InChIKey KYTKOCVFNCZSSC-IWTYRFFRSA-N
Molecular Weight 318.501 g/mol
SMILES [C@@]12([C@](C(C)(C)CCC2)(CCC([C@@]1(CC\C(=C/C(=O)OC)C)[H])=C)[H])C
SPLASH splash10-067m-9400000000-3bfd0212b658377483ce
Source of Spectrum B-48-1357-0
Synonyms (Z)-3-Methyl-5-((1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decahydro-naphthalen-1-yl)-pent-2-enoic acid methyl ester Methyl (2Z)-5-[(1S,8aS)-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl]-3-methyl-2-pentenoate (Z)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-2-pentenoic acid methyl ester Methyl (Z)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoate Methyl (Z)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-3-methyl-pent-2-enoate Methyl (Z)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-pent-2-enoate
Wiley ID 1319020