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5-amino-3-(p-chloroanilino)-1H-1,2,4-triazole

View entire compound with spectra: 4 NMR, 1 FTIR, and 1 MS (GC)

5-amino-3-(p-chloroanilino)-1H-1,2,4-triazole
SpectraBase Compound ID G3Rx1GBMNsN
InChI InChI=1S/C8H8ClN5/c9-5-1-3-6(4-2-5)11-8-12-7(10)13-14-8/h1-4H,(H4,10,11,12,13,14)
InChIKey UPTMGVAONDEFRT-UHFFFAOYSA-N
Mol Weight 209.64 g/mol
Molecular Formula C8H8ClN5
Exact Mass 209.046823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOMUVOVGPyV
Name (5-amino-1H-1,2,4-triazol-3-yl)-(4-chlorophenyl)amine
Alternate Name(s) 3-N-(4-chlorophenyl)-1H-1,2,4-triazole-3,5-diamine N3-(4-chlorophenyl)-1H-1,2,4-triazole-3,5-diamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8ClN5
InChI InChI=1S/C8H8ClN5/c9-5-1-3-6(4-2-5)11-8-12-7(10)13-14-8/h1-4H,(H4,10,11,12,13,14)
InChIKey UPTMGVAONDEFRT-UHFFFAOYSA-N
Molecular Weight 209.640 g/mol
SMILES [nH]1nc(nc1Nc1ccc(cc1)Cl)N
SPLASH splash10-0btc-3890000000-a8cac863df7dd29acb41
Source of Spectrum SK-27-3461-6
Wiley ID 868009