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3-(BENZYLIDENEAMINO)-1H-1,2,4-TRIAZOLE

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

3-(BENZYLIDENEAMINO)-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID 1w4Xa4atTQI
InChI InChI=1S/C9H8N4/c1-2-4-8(5-3-1)6-10-9-11-7-12-13-9/h1-7H,(H,11,12,13)/b10-6+
InChIKey RVXGGSBRFNEABA-UXBLZVDNSA-N
Mol Weight 172.19 g/mol
Molecular Formula C9H8N4
Exact Mass 172.074896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GyIKID9rxc
Name N-[(E)-Phenylmethylidene]-1H-1,2,4-triazol-3-amine
Alternate Name(s) (E)-benzal(1H-1,2,4-triazol-5-yl)amine 1-Phenyl-N-(1H-1,2,4-triazol-5-yl)methanimine 3-(Benzylideneamino)-1H-1,2,4-triazole
CAS Registry Number 110819-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N4
InChI InChI=1S/C9H8N4/c1-2-4-8(5-3-1)6-10-9-11-7-12-13-9/h1-7H,(H,11,12,13)/b10-6+
InChIKey RVXGGSBRFNEABA-UXBLZVDNSA-N
Molecular Weight 172.191 g/mol
SMILES [nH]1nc(nc1)\N=C\c1ccccc1
SPLASH splash10-0fk9-9600000000-7953cbf592d76053e2a8
Wiley ID 1467250