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

*Links on SpectraBase are not permalinks.
N-(4'-Chlorobenzyl)canthadin-imide
SpectraBase Compound ID C8DMToiZtGM
InChI InChI=1S/C17H18ClNO3/c1-16-12-7-8-13(22-12)17(16,2)15(21)19(14(16)20)9-10-3-5-11(18)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12?,13?,16-,17+
InChIKey FJDVTACVLFTIJM-QDIASNEPSA-N
Mol Weight 319.79 g/mol
Molecular Formula C17H18ClNO3
Exact Mass 319.097521 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 AZ3HHzEgRXm
Name N-(4'-Chlorobenzyl)canthadin-imide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18ClNO3
InChI InChI=1S/C17H18ClNO3/c1-16-12-7-8-13(22-12)17(16,2)15(21)19(14(16)20)9-10-3-5-11(18)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12?,13?,16-,17+
InChIKey FJDVTACVLFTIJM-QDIASNEPSA-N
Molecular Weight 319.788 g/mol
SMILES [C@@]12([C@@](C(=O)N(C2=O)Cc2ccc(cc2)Cl)(C2OC1CC2)C)C
SPLASH splash10-00fr-9802000000-d1e0e33494862535bab2
Source of Spectrum SK-29-1615-4
Wiley ID 880695