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Methyl labda-8(17),12E-dien-19-oate
SpectraBase Compound ID 70Ts1lPaelD
InChI InChI=1S/C21H34O2/c1-7-15(2)9-11-17-16(3)10-12-18-20(17,4)13-8-14-21(18,5)19(22)23-6/h9,17-18H,3,7-8,10-14H2,1-2,4-6H3/b15-9+/t17-,18?,20+,21-/m0/s1
InChIKey KJFVBDQIKLRGMW-MGUNVRHXSA-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 E2aSp2KcZeP
Name Methyl labda-8(17),12E-dien-19-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-7-15(2)9-11-17-16(3)10-12-18-20(17,4)13-8-14-21(18,5)19(22)23-6/h9,17-18H,3,7-8,10-14H2,1-2,4-6H3/b15-9+/t17-,18?,20+,21-/m0/s1
InChIKey KJFVBDQIKLRGMW-MGUNVRHXSA-N
Molecular Weight 318.501 g/mol
SMILES [C@@]12(C([C@](C(=O)OC)(C)CCC2)CCC([C@@]1(C\C=C\(CC)C)[H])=C)C
SPLASH splash10-0pdl-3892000000-a248cc9a81bf6fdf4a12
Source of Spectrum AC-1993-704-10
Synonyms Methyl labd-8(17),E-12-dien-19-oate (1S,4aR,5S)-1,4a-Dimethyl-6-methylene-5-((E)-3-methyl-pent-2-enyl)-decahydro-naphthalene-1-carboxylic acid methyl ester Methyl (1S,4aR,5S)-1,4a-dimethyl-6-methylene-5-[(2E)-3-methyl-2-pentenyl]decahydro-1-naphthalenecarboxylate Methyl labda-8(17),12(E)-dien-19-oate
Wiley ID 811631