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1,2,4-Triazine-6-carbonitrile, 2,3,4,5-tetrahydro-5-imino-4-methyl-2-[4-[[(methylamino)carbonyl]oxy]phenyl]-3-oxo-
SpectraBase Compound ID 8buKBCqUSR0
InChI InChI=1S/C13H12N6O3/c1-16-12(20)22-9-5-3-8(4-6-9)19-13(21)18(2)11(15)10(7-14)17-19/h3-6,15H,1-2H3,(H,16,20)
InChIKey VLNMXUHHNKDOKZ-UHFFFAOYSA-N
Mol Weight 300.28 g/mol
Molecular Formula C13H12N6O3
Exact Mass 300.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1znCnBceFWr
Name 1,2,4-Triazine-6-carbonitrile, 2,3,4,5-tetrahydro-5-imino-4-methyl-2-[4-[[(methylamino)carbonyl]oxy]phenyl]-3-oxo-
CAS Registry Number 66706-89-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N6O3
InChI InChI=1S/C13H12N6O3/c1-16-12(20)22-9-5-3-8(4-6-9)19-13(21)18(2)11(15)10(7-14)17-19/h3-6,15H,1-2H3,(H,16,20)
InChIKey VLNMXUHHNKDOKZ-UHFFFAOYSA-N
Molecular Weight 300.278 g/mol
SMILES N(C(Oc1ccc(N2N=C(C(N(C2=O)C)=N)C#N)cc1)=O)C
SPLASH splash10-0006-9405000000-331e096afb4143fb56f5
Source of Spectrum H-61-1177-0
Synonyms 2-(4-(methylcarbamoyl)oxy)phenyl)-3-oxo-4-methyl-5-imino-6-cyano-2,3,4,5-tetrahydro-1,2,4-triazine 4-(6-cyano-5-imino-4-methyl-3-oxo-4,5-dihydro-1,2,4-triazin-2(3H)-yl)phenyl methylcarbamate
Wiley ID 1302440