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2-{2-[[[3-(biphenyl-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]hydra-zono]-4-phenylthiazol-3(2H)-yl}-N'-(4-chlorobenzylidene)aceto-hydrazide

View entire compound with spectra: 1 MS (GC)

2-{2-[[[3-(biphenyl-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]hydra-zono]-4-phenylthiazol-3(2H)-yl}-N'-(4-chlorobenzylidene)aceto-hydrazide
SpectraBase Compound ID 9Dtt7CUmhxN
InChI InChI=1S/C40H30ClN7OS/c41-35-22-16-29(17-23-35)24-42-44-38(49)27-47-37(32-12-6-2-7-13-32)28-50-40(47)45-43-25-34-26-48(36-14-8-3-9-15-36)46-39(34)33-20-18-31(19-21-33)30-10-4-1-5-11-30/h1-26,28H,27H2,(H,44,49)/b42-24+,43-25+,45-40+
InChIKey PSLAGPPNHPNOER-XUGITQBZSA-N
Mol Weight 692.2 g/mol
Molecular Formula C40H30ClN7OS
Exact Mass 691.192107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bj06HJyNrW6
Name 2-{2-[[[3-(biphenyl-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]hydra-zono]-4-phenylthiazol-3(2H)-yl}-N'-(4-chlorobenzylidene)aceto-hydrazide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H30ClN7OS
InChI InChI=1S/C40H30ClN7OS/c41-35-22-16-29(17-23-35)24-42-44-38(49)27-47-37(32-12-6-2-7-13-32)28-50-40(47)45-43-25-34-26-48(36-14-8-3-9-15-36)46-39(34)33-20-18-31(19-21-33)30-10-4-1-5-11-30/h1-26,28H,27H2,(H,44,49)/b42-24+,43-25+,45-40+
InChIKey PSLAGPPNHPNOER-XUGITQBZSA-N
Molecular Weight 692.241 g/mol
SMILES N(\N=C\c1ccc(Cl)cc1)C(CN1\C(=N/N=C/c2c(n[n](c2)-c2ccccc2)-c2ccc(-c3ccccc3)cc2)SC=C1c1ccccc1)=O
SPLASH splash10-0006-0000009000-4dc5ebd644ea9a4a1720
Source of Spectrum Y-49-99-11
Wiley ID 1706434