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2-Phenyl-1H-1,2,4-triazol-3-one
SpectraBase Compound ID K9XI9sTRIBI
InChI InChI=1S/C8H7N3O/c12-8-9-6-10-11(8)7-4-2-1-3-5-7/h1-6H,(H,9,10,12)
InChIKey FMCSQSRRTBWAFT-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C8H7N3O
Exact Mass 161.058912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYHfTFGmLmy
Name 2-Phenyl-2,4-dihydro-1,2,4-triazol-3-one
Alternate Name(s) 2-Phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N3O
InChI InChI=1S/C8H7N3O/c12-8-9-6-10-11(8)7-4-2-1-3-5-7/h1-6H,(H,9,10,12)
InChIKey FMCSQSRRTBWAFT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200200037
Molecular Weight 161.164 g/mol
SMILES N1C=NN(C1=O)c1ccccc1
SPLASH splash10-01ox-9700000000-ed50675d765743079a13
Source of Spectrum QA-49-245-7a
Wiley ID 1795565