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3-Hexanone, 1-(decahydro-2,8a-dimethyl-1-naphthalenyl)-, (1.alpha.,2.beta.,4a.beta.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID EyJ4Kz9oaZv
InChI InChI=1S/C18H32O/c1-4-7-16(19)11-12-17-14(2)9-10-15-8-5-6-13-18(15,17)3/h14-15,17H,4-13H2,1-3H3/t14-,15-,17+,18+/m0/s1
InChIKey VJYGQMFQEZFPJQ-CWLKWCNXSA-N
Mol Weight 264.5 g/mol
Molecular Formula C18H32O
Exact Mass 264.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5IOnwfEsft
Name 3-Hexanone, 1-(decahydro-2,8a-dimethyl-1-naphthalenyl)-, (1.alpha.,2.beta.,4a.beta.,8a.alpha.)-(.+-.)-
CAS Registry Number 106201-95-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32O
InChI InChI=1S/C18H32O/c1-4-7-16(19)11-12-17-14(2)9-10-15-8-5-6-13-18(15,17)3/h14-15,17H,4-13H2,1-3H3/t14-,15-,17+,18+/m0/s1
InChIKey VJYGQMFQEZFPJQ-CWLKWCNXSA-N
Molecular Weight 264.453 g/mol
SMILES [C@]12([C@](CCC(=O)CCC)([C@@](C)(CC[C@@]2(CCCC1)[H])[H])[H])C
SPLASH splash10-05fu-9410000000-b2831faf1c4b75417041
Source of Spectrum H-68-1982-97
Synonyms (+-)-1-(1,2,3,4,a.alpha.,5,6,7,8,8a-decahydro-2.alpha.,8a.beta.-dimethyl-1.beta.-naphthyl)-3-hexanon 1-[(1R,2S,4aS,8aR)-2,8a-dimethyldecahydro-1-naphthalenyl]-3-hexanone
Wiley ID 1268583