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(4-chloro-benzylsulfanyl)-acetic acid (5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-ylmethylene)-hydrazide
SpectraBase Compound ID 1Ohxditg49
InChI InChI=1S/C20H19ClN4O2S/c1-14-18(20(27)25(24-14)17-5-3-2-4-6-17)11-22-23-19(26)13-28-12-15-7-9-16(21)10-8-15/h2-11,27H,12-13H2,1H3,(H,23,26)/b22-11+
InChIKey PPFGQEJPTGAANS-SSDVNMTOSA-N
Mol Weight 414.91 g/mol
Molecular Formula C20H19ClN4O2S
Exact Mass 414.091725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGKV90A4xY5
Name (4-chloro-benzylsulfanyl)-acetic acid (5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-ylmethylene)-hydrazide
Alternate Name(s) 2-[(4-chlorobenzyl)sulfanyl]-N'-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide 2-[(4-chlorobenzyl)sulfanyl]-N'-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClN4O2S
InChI InChI=1S/C20H19ClN4O2S/c1-14-18(20(27)25(24-14)17-5-3-2-4-6-17)11-22-23-19(26)13-28-12-15-7-9-16(21)10-8-15/h2-11,27H,12-13H2,1H3,(H,23,26)/b22-11+
InChIKey PPFGQEJPTGAANS-SSDVNMTOSA-N
Molecular Weight 414.911 g/mol
SMILES N(C(=O)CSCc1ccc(cc1)Cl)\N=C\c1c(n[n](c1O)-c1ccccc1)C
SPLASH splash10-004i-1970000000-8a633ad298a1a2f60be6
Wiley ID 1463214