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

*Links on SpectraBase are not permalinks.
5-(4-Chlorophenyl)-7-phenyl-2,4,5,6-tetrahydro-3H-1,2,4-triazepin-3-one
SpectraBase Compound ID KqLQa82PwQv
InChI InChI=1S/C16H14ClN3O/c17-13-8-6-12(7-9-13)14-10-15(19-20-16(21)18-14)11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,18,20,21)
InChIKey PFDCAUDLFIOTRO-UHFFFAOYSA-N
Mol Weight 299.76 g/mol
Molecular Formula C16H14ClN3O
Exact Mass 299.08254 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 D4ZdR87K8eR
Name 5-(4-Chlorophenyl)-7-phenyl-2,4,5,6-tetrahydro-3H-1,2,4-triazepin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClN3O
InChI InChI=1S/C16H14ClN3O/c17-13-8-6-12(7-9-13)14-10-15(19-20-16(21)18-14)11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,18,20,21)
InChIKey PFDCAUDLFIOTRO-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2015.10.079
Molecular Weight 299.761 g/mol
SMILES N1C(NN=C(CC1c1ccc(cc1)Cl)c1ccccc1)=O
SPLASH splash10-04i0-4920000000-7233b5d1b5e68721a1c6
Source of Spectrum F-71-9542-29c
Wiley ID 1803339