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

*Links on SpectraBase are not permalinks.
(+-)-3,4,4a.alpha.,5,6,7,8,8a-octahydro-2.beta.,8a.beta.-dimethyl-1(2h)-napthalinone
SpectraBase Compound ID 79HIj26vKci
InChI InChI=1S/C12H20O/c1-9-6-7-10-5-3-4-8-12(10,2)11(9)13/h9-10H,3-8H2,1-2H3/t9-,10+,12-/m0/s1
InChIKey ATHZBEVFBUKMSS-UMNHJUIQSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 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 G8Q2QUtZgup
Name (+-)-3,4,4a.alpha.,5,6,7,8,8a-octahydro-2.beta.,8a.beta.-dimethyl-1(2h)-napthalinone
CAS Registry Number 106249-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-9-6-7-10-5-3-4-8-12(10,2)11(9)13/h9-10H,3-8H2,1-2H3/t9-,10+,12-/m0/s1
InChIKey ATHZBEVFBUKMSS-UMNHJUIQSA-N
Molecular Weight 180.291 g/mol
SMILES [C@@]12(C(=O)[C@@](C)(CC[C@]2(CCCC1)[H])[H])C
SPLASH splash10-00sm-9400000000-0e5eb78736e420f900e7
Source of Spectrum H-68-1981-91
Synonyms (+-)-3,4,4a.alpha.,5,6,7,8,8a-Octahydro-2.beta.,8a.beta.-dimethyl-1(2H)-napthalinon (2S,4aR,8aS)-2,8a-dimethyloctahydro-1(2H)-naphthalenone
Wiley ID 1176885