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

*Links on SpectraBase are not permalinks.
3-Cinnamoyl-7a-phenyl-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
SpectraBase Compound ID BNJCvmg199c
InChI InChI=1S/C23H21NO2/c25-20(15-14-17-9-3-1-4-10-17)21-19-13-7-8-16-23(19,24-22(21)26)18-11-5-2-6-12-18/h1-6,9-12,14-15H,7-8,13,16H2,(H,24,26)
InChIKey NXJKXNGEXJHBCK-UHFFFAOYSA-N
Mol Weight 343.43 g/mol
Molecular Formula C23H21NO2
Exact Mass 343.157229 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 1DyKrwssKNT
Name 3-Cinnamoyl-7a-phenyl-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.157228918 u
Formula C23H21NO2
InChI InChI=1S/C23H21NO2/c25-20(15-14-17-9-3-1-4-10-17)21-19-13-7-8-16-23(19,24-22(21)26)18-11-5-2-6-12-18/h1-6,9-12,14-15H,7-8,13,16H2,(H,24,26)
InChIKey NXJKXNGEXJHBCK-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP2010SE
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.2c02935
Molecular Weight 343.426 g/mol
Quality 200
Reported Formula C23H21NO2
SMILES N1C(C(=C2C1(CCCC2)C=1C=CC=CC1)C(C=CC1=CC=CC=C1)=O)=O
SPLASH splash10-0gwf-2967000000-354ea0f3f8cdcc251343
Source of Spectrum JOC-88-3962-4at (DOI: 10.1021/acs.joc.2c02935)
Wiley ID 1912718