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1'-Methylethyl 4,5-dihydro-3-(1"-methylethoxy)-5-thioxo-4-phenyl-1H-1,2,4-triazole-1-carboxylate
SpectraBase Compound ID K3dINxitMJx
InChI InChI=1S/C15H19N3O3S/c1-10(2)20-13-16-18(15(19)21-11(3)4)14(22)17(13)12-8-6-5-7-9-12/h5-11H,1-4H3
InChIKey ZASZSBNIOOUSKR-UHFFFAOYSA-N
Mol Weight 321.4 g/mol
Molecular Formula C15H19N3O3S
Exact Mass 321.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fi7SQzW6K
Name 1'-Methylethyl 4,5-dihydro-3-(1"-methylethoxy)-5-thioxo-4-phenyl-1H-1,2,4-triazole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19N3O3S
InChI InChI=1S/C15H19N3O3S/c1-10(2)20-13-16-18(15(19)21-11(3)4)14(22)17(13)12-8-6-5-7-9-12/h5-11H,1-4H3
InChIKey ZASZSBNIOOUSKR-UHFFFAOYSA-N
Molecular Weight 321.395 g/mol
SMILES C1(N(N=C(N1c1ccccc1)OC(C)C)C(OC(C)C)=O)=S
SPLASH splash10-00dl-2429000000-632b5980ce54da00f527
Source of Spectrum C-88-2780-2
Synonyms isopropyl 3-isopropoxy-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazole-1-carboxylate
Wiley ID 1590381