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

*Links on SpectraBase are not permalinks.
1,2,4-Triazine-6-carbonitrile, 2,3,4,5-tetrahydro-5-imino-3-oxo-2,4-diphenyl-
SpectraBase Compound ID 5u2GX84iUfQ
InChI InChI=1S/C16H11N5O/c17-11-14-15(18)20(12-7-3-1-4-8-12)16(22)21(19-14)13-9-5-2-6-10-13/h1-10,18H
InChIKey GGGPWFVHFGRFFD-UHFFFAOYSA-N
Mol Weight 289.3 g/mol
Molecular Formula C16H11N5O
Exact Mass 289.09636 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 2FBdyK807Vv
Name 1,2,4-Triazine-6-carbonitrile, 2,3,4,5-tetrahydro-5-imino-3-oxo-2,4-diphenyl-
CAS Registry Number 66706-94-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N5O
InChI InChI=1S/C16H11N5O/c17-11-14-15(18)20(12-7-3-1-4-8-12)16(22)21(19-14)13-9-5-2-6-10-13/h1-10,18H
InChIKey GGGPWFVHFGRFFD-UHFFFAOYSA-N
Molecular Weight 289.298 g/mol
SMILES N=C1N(C(N(N=C1C#N)c1ccccc1)=O)c1ccccc1
SPLASH splash10-00p3-9440000000-313d942f10c7eb87192f
Source of Spectrum H-61-1177-0
Synonyms 2,4-Diphenyl-3-oxo-5-imino-6-cyano-2,3,4,5-tetrahydro-1,2,4-triazine 5-imino-3-oxo-2,4-diphenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
Wiley ID 1292596