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3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(1-methylethyl)-4-phenyl-
SpectraBase Compound ID BMuxzy5fCOG
InChI InChI=1S/C11H13N3O/c1-8(2)10-12-13-11(15)14(10)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,13,15)
InChIKey CAWBUDXLGQPEDN-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C11H13N3O
Exact Mass 203.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQHYtXmXjkY
Name 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(1-methylethyl)-4-phenyl-
CAS Registry Number 66921-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N3O
InChI InChI=1S/C11H13N3O/c1-8(2)10-12-13-11(15)14(10)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,13,15)
InChIKey CAWBUDXLGQPEDN-UHFFFAOYSA-N
Molecular Weight 203.245 g/mol
SMILES N1N=C(N(C1=O)c1ccccc1)C(C)C
SPLASH splash10-0udi-9880000000-98d8c364b3c5b8e76a33
Source of Spectrum W5-1989-9871-1
Synonyms 5-Isopropyl-4-phenyl-4H-1,2,4-triazol-3-ol .delta.2-1,2,4-triazolin-5-one, 3-isopropyl-4-phenyl- 3-Hydroxy-4-phenyl-5-isopropyl-1,2,4-triazole 3-isopropyl-4-phenyl-1H-1,2,4-triazol-5-one 4-Phenyl-3-propan-2-yl-1H-1,2,4-triazol-5-one
Wiley ID 1200771