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3-METHYL-4-PHENYL-delta2-1,2,4-TRIAZOLIN-5-ONE
SpectraBase Compound ID EOje82PpiHj
InChI InChI=1S/C9H9N3O/c1-7-10-11-9(13)12(7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,13)
InChIKey CCPJMTJIFZSNOH-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C9H9N3O
Exact Mass 175.074562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bA5Db9fFql
Name 3-Methyl-4-phenyl-1H-1,2,4-triazol-5-one
Alternate Name(s) 5-Methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
CAS Registry Number 1010-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3O
InChI InChI=1S/C9H9N3O/c1-7-10-11-9(13)12(7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,13)
InChIKey CCPJMTJIFZSNOH-UHFFFAOYSA-N
Molecular Weight 175.191 g/mol
SMILES N1N=C(N(C1=O)c1ccccc1)C
SPLASH splash10-0296-9400000000-33876c5d3bd36b1f53ab
Source of Spectrum Y-15-238-0
Wiley ID 1171367