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3-(2-cyanoacetamido)-4-oxo-3H-benzo[d][1,2,3]triazine
SpectraBase Compound ID KelZlp7c0gL
InChI InChI=1S/C10H7N5O2/c11-6-5-9(16)13-15-10(17)7-3-1-2-4-8(7)12-14-15/h1-4H,5H2,(H,13,16)
InChIKey UYMGFEOYCODDGW-UHFFFAOYSA-N
Mol Weight 229.2 g/mol
Molecular Formula C10H7N5O2
Exact Mass 229.059974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFulkp3fOWk
Name 3-(2-cyanoacetamido)-4-oxo-3H-benzo[d][1,2,3]triazine
Appearance Buff crystals
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Formula C10H7N5O2
InChI InChI=1S/C10H7N5O2/c11-6-5-9(16)13-15-10(17)7-3-1-2-4-8(7)12-14-15/h1-4H,5H2,(H,13,16)
InChIKey UYMGFEOYCODDGW-UHFFFAOYSA-N
Instrument Name Thermo Scientific Focus-DSQII Quadrupole GC-MS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3452
Molecular Weight 229.199 g/mol
SMILES N(N1C(c2ccccc2N=N1)=O)C(CC#N)=O
SPLASH splash10-003r-2910000000-1b6d2054015df890cde8
Source of Spectrum Y-56-810-5
Wiley ID 1861153