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1-Naphthalenecarboxylic acid, decahydro-5,5,8a-trimethyl-2-oxo-1-(2-propenyl)-, methyl ester, (1.alpha.,4a.beta.,8a.beta.)-(.+-.)-

View entire compound with spectra: 2 MS (GC)

1-Naphthalenecarboxylic acid, decahydro-5,5,8a-trimethyl-2-oxo-1-(2-propenyl)-, methyl ester, (1.alpha.,4a.beta.,8a.beta.)-(.+-.)-
SpectraBase Compound ID A3BxEvqsFUK
InChI InChI=1S/C18H28O3/c1-6-10-18(15(20)21-5)14(19)9-8-13-16(2,3)11-7-12-17(13,18)4/h6,13H,1,7-12H2,2-5H3/t13-,17+,18+/m1/s1
InChIKey ZZYVVNIYFYBLHK-BVGQSLNGSA-N
Mol Weight 292.42 g/mol
Molecular Formula C18H28O3
Exact Mass 292.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ue464iHwhm
Name 1-Naphthalenecarboxylic acid, decahydro-5,5,8a-trimethyl-2-oxo-1-(2-propenyl)-, methyl ester, (1.alpha.,4a.beta.,8a.beta.)-(.+-.)-
CAS Registry Number 131758-15-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O3
InChI InChI=1S/C18H28O3/c1-6-10-18(15(20)21-5)14(19)9-8-13-16(2,3)11-7-12-17(13,18)4/h6,13H,1,7-12H2,2-5H3/t13-,17+,18+/m1/s1
InChIKey ZZYVVNIYFYBLHK-BVGQSLNGSA-N
Molecular Weight 292.419 g/mol
SMILES [C@]1([C@@]2([C@](C(C)(C)CCC2)([H])CCC1=O)C)(C(=O)OC)CC=C
SPLASH splash10-0a4i-8900000000-67b04398babe9b379cc8
Source of Spectrum H-73-1946-26
Synonyms Methyl (1S)-1,2,3,4,4a.beta.,5,6,7,8,8a-decahydro-5,5,8a.beta.-trimethyl-2-oxo-1-(prop-2'-enyl)naphthalene-1-carboxylate Methyl (1R)-1,2,3,4,4a.beta.,5,6,7,8,8a-decahydro-5,5,8a.beta.-trimethyl-2-oxo-1-(prop-2'-enyl)naphthalene-1-carboxylate Methyl (1S,4aR,8aS)-1-allyl-5,5,8a-trimethyl-2-oxodecahydro-1-naphthalenecarboxylate
Wiley ID 1295733