For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl labda-12-en-19-oate
SpectraBase Compound ID 9i0aAyFA2Ja
InChI InChI=1S/C21H36O2/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/h9,16-18H,7-8,10-14H2,1-6H3/b15-9+/t16-,17-,18+,20+,21-/m0/s1
InChIKey ZUJZCOSZACWATP-UYIKBOLCSA-N
Mol Weight 320.5 g/mol
Molecular Formula C21H36O2
Exact Mass 320.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4xM74HmUnjp
Name Methyl labda-12-en-19-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O2
InChI InChI=1S/C21H36O2/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/h9,16-18H,7-8,10-14H2,1-6H3/b15-9+/t16-,17-,18+,20+,21-/m0/s1
InChIKey ZUJZCOSZACWATP-UYIKBOLCSA-N
Molecular Weight 320.517 g/mol
SMILES [C@@]12([C@]([C@](C(=O)OC)(C)CCC2)(CC[C@@]([C@@]1(C\C=C\(CC)C)[H])(C)[H])[H])C
SPLASH splash10-004r-5961000000-42e5ca6964aa200aabf4
Source of Spectrum Y4-89-720-9
Synonyms Methyl (1S,4aR,5S,6S,8aR)-1,4a,6-trimethyl-5-[(2E)-3-methyl-2-pentenyl]decahydro-1-naphthalenecarboxylate
Wiley ID 1550334