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Propanimidic acid, N-(1,5-dihydro-5-oxo-3-phenyl-4H-1,2,4-triazol-4-yl)-, ethyl ester
SpectraBase Compound ID GsZ394asb02
InChI InChI=1S/C13H16N4O2/c1-3-11(19-4-2)16-17-12(14-15-13(17)18)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H,15,18)/b16-11+
InChIKey YWOFFSQNOWZWMY-LFIBNONCSA-N
Mol Weight 260.3 g/mol
Molecular Formula C13H16N4O2
Exact Mass 260.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BEspxWQE8Dq
Name Propanimidic acid, N-(1,5-dihydro-5-oxo-3-phenyl-4H-1,2,4-triazol-4-yl)-, ethyl ester
Alternate Name(s) Ethyl (1E)-N-(5-oxo-3-phenyl-1,5-dihydro-4H-1,2,4-triazol-4-yl)propanimidoate Ethyl-N-(3-phenyl(1H)-1,2,4-triazole-5-one-4-yl)propionamidate
CAS Registry Number 77452-33-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N4O2
InChI InChI=1S/C13H16N4O2/c1-3-11(19-4-2)16-17-12(14-15-13(17)18)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H,15,18)/b16-11+
InChIKey YWOFFSQNOWZWMY-LFIBNONCSA-N
Molecular Weight 260.297 g/mol
SMILES N1N=C(N(C1=O)\N=C/(OCC)CC)c1ccccc1
SPLASH splash10-06vi-9830000000-67e2ee6d4a7bd1712a94
Source of Spectrum Y-17-1695-0
Wiley ID 1263512