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

*Links on SpectraBase are not permalinks.
1(2H)-Naphthalenone, 3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethenyl)-, (3.alpha.,4a.alpha.,5.alpha.)-(.+-.)-
SpectraBase Compound ID FqxislZFXvs
InChI InChI=1S/C15H22O/c1-10(2)12-8-14(16)13-7-5-6-11(3)15(13,4)9-12/h7,11-12H,1,5-6,8-9H2,2-4H3/t11-,12+,15+/m1/s1
InChIKey BSUGIIZTULADOL-XUJVJEKNSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 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 L1PD9r5aXPN
Name 1(2H)-Naphthalenone, 3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethenyl)-, (3.alpha.,4a.alpha.,5.alpha.)-(.+-.)-
CAS Registry Number 53797-64-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-10(2)12-8-14(16)13-7-5-6-11(3)15(13,4)9-12/h7,11-12H,1,5-6,8-9H2,2-4H3/t11-,12+,15+/m1/s1
InChIKey BSUGIIZTULADOL-XUJVJEKNSA-N
Molecular Weight 218.340 g/mol
SMILES [C@]12(C(C(=O)C[C@@](C2)(C(=C)C)[H])=CCC[C@]1(C)[H])C
SPLASH splash10-0aor-0970000000-5c09111dabf35679bcf1
Source of Spectrum J-40-1832-0
Synonyms (.+-.)-Eremophilone (3R,4aS,5R)-3-isopropenyl-4a,5-dimethyl-3,4,4a,5,6,7-hexahydro-1(2H)-naphthalenone Eremophilone
Wiley ID 1218214