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N-[(E)-(3-nitrophenyl)methylidene]-4H-1,2,4-triazol-4-amine
SpectraBase Compound ID EGia0e8PSXh
InChI InChI=1S/C9H7N5O2/c15-14(16)9-3-1-2-8(4-9)5-12-13-6-10-11-7-13/h1-7H/b12-5+
InChIKey FAUGLCGCOYUPKR-LFYBBSHMSA-N
Mol Weight 217.19 g/mol
Molecular Formula C9H7N5O2
Exact Mass 217.059974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1k4I38977Or
Name N-[(E)-(3-Nitrophenyl)methylidene]-4H-1,2,4-triazol-4-amine
CAS Registry Number 32787-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N5O2
InChI InChI=1S/C9H7N5O2/c15-14(16)9-3-1-2-8(4-9)5-12-13-6-10-11-7-13/h1-7H/b12-5+
InChIKey FAUGLCGCOYUPKR-LFYBBSHMSA-N
Molecular Weight 217.188 g/mol
SMILES c1[n](cnn1)\N=C\c1cc(ccc1)N(=O)=O
SPLASH splash10-0ug0-9100000000-095e533802b637cde376
Synonyms (E)-(3-nitrobenzylidene)-(1,2,4-triazol-4-yl)amine 1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine 4-(3-Nitrobenzylideneamino)-4H-1,2,4-triazole
Wiley ID 1469501