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-4-methyl-2-(3-nitrophenyl)-3-oxo-
SpectraBase Compound ID 47tAVQ4zrov
InChI InChI=1S/C11H8N6O3/c1-15-10(13)9(6-12)14-16(11(15)18)7-3-2-4-8(5-7)17(19)20/h2-5,13H,1H3
InChIKey DSSNBTPLORHPBW-UHFFFAOYSA-N
Mol Weight 272.22 g/mol
Molecular Formula C11H8N6O3
Exact Mass 272.065788 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 9IaHV4KQEoO
Name 1,2,4-Triazine-6-carbonitrile, 2,3,4,5-tetrahydro-5-imino-4-methyl-2-(3-nitrophenyl)-3-oxo-
CAS Registry Number 66706-86-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N6O3
InChI InChI=1S/C11H8N6O3/c1-15-10(13)9(6-12)14-16(11(15)18)7-3-2-4-8(5-7)17(19)20/h2-5,13H,1H3
InChIKey DSSNBTPLORHPBW-UHFFFAOYSA-N
Molecular Weight 272.224 g/mol
SMILES N=C1C(=NN(C(N1C)=O)c1cc(N(=O)=O)ccc1)C#N
SPLASH splash10-00di-3950000000-fdcd87b1a41f8bd21e00
Source of Spectrum H-61-1177-0
Synonyms 2-(3-Nitrophenyl)-3-oxo-4-methyl-5-imino-6-cyano-2,3,4,5-tetrahydro-1,2,4-triazine 5-imino-4-methyl-2-(3-nitrophenyl)-3-oxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
Wiley ID 1275689