For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Propionyloxy-3-phenyl-4-amino-4,5(1H)-dihydro-1,2,4-triazole-5-one
SpectraBase Compound ID ITAmsJz3EZf
InChI InChI=1S/C11H12N4O3/c1-2-9(16)18-15-11(17)14(12)10(13-15)8-6-4-3-5-7-8/h3-7H,2,12H2,1H3
InChIKey UWHPRNGOWOSGPU-UHFFFAOYSA-N
Mol Weight 248.24 g/mol
Molecular Formula C11H12N4O3
Exact Mass 248.09094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5bTKbZiCIBi
Name 1-Propionyloxy-3-phenyl-4-amino-4,5(1H)-dihydro-1,2,4-triazole-5-one
Alternate Name(s) 4-Amino-5-phenyl-2-(propionyloxy)-2,4-dihydro-3H-1,2,4-triazol-3-one
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N4O3
InChI InChI=1S/C11H12N4O3/c1-2-9(16)18-15-11(17)14(12)10(13-15)8-6-4-3-5-7-8/h3-7H,2,12H2,1H3
InChIKey UWHPRNGOWOSGPU-UHFFFAOYSA-N
Molecular Weight 248.242 g/mol
SMILES NN1C(N(OC(=O)CC)N=C1c1ccccc1)=O
SPLASH splash10-0fb9-5920000000-94fdd2e2a18e0bb1d5a4
Source of Spectrum O-14-376-4
Wiley ID 1250612