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4-Methylbenzenesulfonic acid N'-(4-fluorobenzylidene)-N-(3-oxobutyl)hydrazide
SpectraBase Compound ID KCOnqacYJkk
InChI InChI=1S/C18H19FN2O3S/c1-14-3-9-18(10-4-14)25(23,24)21(12-11-15(2)22)20-13-16-5-7-17(19)8-6-16/h3-10,13H,11-12H2,1-2H3/b20-13+
InChIKey DOXZKLBEJGLOJM-DEDYPNTBSA-N
Mol Weight 362.42 g/mol
Molecular Formula C18H19FN2O3S
Exact Mass 362.110042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLF9BjU0S7d
Name 4-Methylbenzenesulfonic acid N'-(4-fluorobenzylidene)-N-(3-oxobutyl)hydrazide
Alternate Name(s) N'-[(E)-(4-fluorophenyl)methylidene]-4-methyl-N-(3-oxobutyl)benzenesulfonohydrazide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19FN2O3S
InChI InChI=1S/C18H19FN2O3S/c1-14-3-9-18(10-4-14)25(23,24)21(12-11-15(2)22)20-13-16-5-7-17(19)8-6-16/h3-10,13H,11-12H2,1-2H3/b20-13+
InChIKey DOXZKLBEJGLOJM-DEDYPNTBSA-N
Molecular Weight 362.419 g/mol
SMILES c1(ccc(cc1)C)S(=O)(=O)N(\N=C\c1ccc(cc1)F)CCC(C)=O
SPLASH splash10-0ap0-0920000000-bded6ee5639ffd2d35db
Source of Spectrum KC-61-7285-3
Wiley ID 1629944