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

*Links on SpectraBase are not permalinks.
(4R,4aS)-1-Benzyl-4,4a-dimethyl-3,4,4a,5,6,7-hexahydroquinolin-2(1H)-one
SpectraBase Compound ID KQV9pVh7KCA
InChI InChI=1S/C18H23NO/c1-14-12-17(20)19(13-15-8-4-3-5-9-15)16-10-6-7-11-18(14,16)2/h3-5,8-10,14H,6-7,11-13H2,1-2H3/t14-,18+/m1/s1
InChIKey CPZYTHHIFPWSGB-KDOFPFPSSA-N
Mol Weight 269.39 g/mol
Molecular Formula C18H23NO
Exact Mass 269.177964 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 2WjGfKNapVf
Name (4R,4aS)-1-Benzyl-4,4a-dimethyl-3,4,4a,5,6,7-hexahydroquinolin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO
InChI InChI=1S/C18H23NO/c1-14-12-17(20)19(13-15-8-4-3-5-9-15)16-10-6-7-11-18(14,16)2/h3-5,8-10,14H,6-7,11-13H2,1-2H3/t14-,18+/m1/s1
InChIKey CPZYTHHIFPWSGB-KDOFPFPSSA-N
Molecular Weight 269.388 g/mol
SMILES C=12N(C(C[C@]([C@]2(C)CCCC1)(C)[H])=O)Cc1ccccc1
SPLASH splash10-00kf-7290000000-0b8638d42063013d4484
Source of Spectrum J-66-259-8
Synonyms (4R,4aS)-1-benzyl-4,4a-dimethyl-3,4,4a,5,6,7-hexahydro-2(1H)-quinolinone cis-1-Benzyl-4,4a-dimethyl-3,4,4a,5,6,7-hexahydroquinolin-2(1H)-one
Wiley ID 1534158