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1-(acetylamino)-4-benzyl-1H-1,2,4-triazol-4-ium

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1-(acetylamino)-4-benzyl-1H-1,2,4-triazol-4-ium
SpectraBase Compound ID C3oKIWcK5JC
InChI InChI=1S/C11H12N4O/c1-10(16)13-15-9-14(8-12-15)7-11-5-3-2-4-6-11/h2-6,8-9H,7H2,1H3/p+1
InChIKey FQMGSICMMHXTFB-UHFFFAOYSA-O
Mol Weight 217.25 g/mol
Molecular Formula C11H13N4O
Exact Mass 217.108936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cGiJOQyWdH
Name 1-(acetylamino)-4-benzyl-1H-1,2,4-triazol-4-ium
CAS Registry Number 25857-78-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N4O
InChI InChI=1S/C11H12N4O/c1-10(16)13-15-9-14(8-12-15)7-11-5-3-2-4-6-11/h2-6,8-9H,7H2,1H3/p+1
InChIKey FQMGSICMMHXTFB-UHFFFAOYSA-O
Molecular Weight 217.252 g/mol
SMILES N([n]1c[n+](cn1)Cc1ccccc1)C(=O)C
SPLASH splash10-0006-9830000000-20a252aec589ba641599
Source of Spectrum EP-2207-0-0
Synonyms N-(4-benzyl-1,2,4-triazol-4-ium-1-yl)acetamide N-[4-(phenylmethyl)-1,2,4-triazol-4-ium-1-yl]acetamide N-[4-(phenylmethyl)-1,2,4-triazol-4-ium-1-yl]ethanamide
Wiley ID 1215266