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

*Links on SpectraBase are not permalinks.
1-(4-besylbenzoyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one
SpectraBase Compound ID AhvU5VlMpxF
InChI InChI=1S/C22H23NO4S/c24-21-14-15-23(20-9-5-4-8-19(20)21)22(25)16-10-12-18(13-11-16)28(26,27)17-6-2-1-3-7-17/h1-3,6-7,10-13,19-20H,4-5,8-9,14-15H2
InChIKey ACKHYAGNJYIIKC-UHFFFAOYSA-N
Mol Weight 397.49 g/mol
Molecular Formula C22H23NO4S
Exact Mass 397.134779 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 BkxKVhfMz8G
Name 1-(4-besylbenzoyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO4S
InChI InChI=1S/C22H23NO4S/c24-21-14-15-23(20-9-5-4-8-19(20)21)22(25)16-10-12-18(13-11-16)28(26,27)17-6-2-1-3-7-17/h1-3,6-7,10-13,19-20H,4-5,8-9,14-15H2
InChIKey ACKHYAGNJYIIKC-UHFFFAOYSA-N
Molecular Weight 397.489 g/mol
SMILES c1ccc(S(c2ccc(C(N3C4C(CCCC4)C(CC3)=O)=O)cc2)(=O)=O)cc1
SPLASH splash10-002b-9854000000-d6342ac4bd6f879978bb
Synonyms 1-[4-(benzenesulfonyl)benzoyl]-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one 1-[4-(phenylsulfonyl)phenyl]carbonyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one 1-[[4-(benzenesulfonyl)phenyl]-oxomethyl]-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one
Wiley ID 1442497