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3-Amino-6-(phenylethynyl)-1,2,4-triazine N2-oxide

View entire compound with spectra: 1 MS (GC)

3-Amino-6-(phenylethynyl)-1,2,4-triazine N2-oxide
SpectraBase Compound ID ApAcZtinqQw
InChI InChI=1S/C11H8N4O/c12-11-13-8-10(14-15(11)16)7-6-9-4-2-1-3-5-9/h1-5,8H,(H2,12,13)
InChIKey KLWGUIIDLJVOCH-UHFFFAOYSA-N
Mol Weight 212.21 g/mol
Molecular Formula C11H8N4O
Exact Mass 212.069811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21haXpV7yfC
Name 3-Amino-6-(phenylethynyl)-1,2,4-triazine N2-oxide
Alternate Name(s) 2-Oxido-6-(phenylethynyl)-1,2,4-triazin-3-ylamine 6-(Phenylethynyl)-1,2,4-triazin-3-amine 2-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N4O
InChI InChI=1S/C11H8N4O/c12-11-13-8-10(14-15(11)16)7-6-9-4-2-1-3-5-9/h1-5,8H,(H2,12,13)
InChIKey KLWGUIIDLJVOCH-UHFFFAOYSA-N
Molecular Weight 212.212 g/mol
SMILES Nc1[n+](nc(C#Cc2ccccc2)cn1)[O-]
SPLASH splash10-01rx-0900000000-cb0885676f480a5a161d
Source of Spectrum QB-17-1081-3
Wiley ID 841708