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Dodecanoic acid (S)-5-((1R,2S,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-decahydro-naphthalen-1-yl)-3-methyl-pentyl ester
SpectraBase Compound ID JVM1f6Kc9kD
InChI InChI=1S/C32H60O3/c1-7-8-9-10-11-12-13-14-15-17-29(33)35-25-21-26(2)18-19-28-31(5)23-16-22-30(3,4)27(31)20-24-32(28,6)34/h26-28,34H,7-25H2,1-6H3/t26-,27?,28-,31+,32-/m1/s1
InChIKey LGASVKVEKQBJHK-JIBPVKEMSA-N
Mol Weight 492.8 g/mol
Molecular Formula C32H60O3
Exact Mass 492.454246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FslGzunIL7v
Name Dodecanoic acid (S)-5-((1R,2S,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-decahydro-naphthalen-1-yl)-3-methyl-pentyl ester
Alternate Name(s) labdan-8.alpha.-ol-15-lauroate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H60O3
InChI InChI=1S/C32H60O3/c1-7-8-9-10-11-12-13-14-15-17-29(33)35-25-21-26(2)18-19-28-31(5)23-16-22-30(3,4)27(31)20-24-32(28,6)34/h26-28,34H,7-25H2,1-6H3/t26-,27?,28-,31+,32-/m1/s1
InChIKey LGASVKVEKQBJHK-JIBPVKEMSA-N
Molecular Weight 492.829 g/mol
SMILES O[C@]1([C@@]([C@@]2(C(C(C)(C)CCC2)CC1)C)(CC[C@](CCOC(=O)CCCCCCCCCCC)(C)[H])[H])C
SPLASH splash10-0006-0900600000-7c04cc12e2eea8e47957
Source of Spectrum F2-45-3160-6
Wiley ID 1689316