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(NE)-N-(3-butyl-5-phenyl-1,3,4-thiadiazol-2-ylidene)nitrous amide
SpectraBase Compound ID 4L5mJ0Taitn
InChI InChI=1S/C12H14N4OS/c1-2-3-9-16-12(13-15-17)18-11(14-16)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3/b13-12+
InChIKey LKXBLZMVVUDXIU-OUKQBFOZSA-N
Mol Weight 262.33 g/mol
Molecular Formula C12H14N4OS
Exact Mass 262.088832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUfiww9JwNF
Name (NE)-N-(3-butyl-5-phenyl-1,3,4-thiadiazol-2-ylidene)nitrous amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N4OS
InChI InChI=1S/C12H14N4OS/c1-2-3-9-16-12(13-15-17)18-11(14-16)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3/b13-12+
InChIKey LKXBLZMVVUDXIU-OUKQBFOZSA-N
Molecular Weight 262.331 g/mol
SMILES C=1(S\C(N(N1)CCCC)=N\N=O)c1ccccc1
SPLASH splash10-0fir-4920000000-1d1ccbc67350f1190172
Source of Spectrum D8-328-20-15
Wiley ID 1515552