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3-[3-(Benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N'-[1-(5-methyl-2-phenyl-1H-imidazol-4-yl)ethylidene]acrylohydrazide
SpectraBase Compound ID 1hVLTBdK0Fe
InChI InChI=1S/C33H25N7O2/c1-21-30(36-32(35-21)23-11-5-3-6-12-23)22(2)37-38-33(41)25(19-34)17-26-20-40(27-14-7-4-8-15-27)39-31(26)29-18-24-13-9-10-16-28(24)42-29/h3-18,20H,1-2H3,(H,35,36)(H,38,41)/b25-17+,37-22+
InChIKey OXKZYXSPCWQEAA-JPWVXYTOSA-N
Mol Weight 551.6 g/mol
Molecular Formula C33H25N7O2
Exact Mass 551.206973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVXysintUEz
Name 3-[3-(Benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N'-[1-(5-methyl-2-phenyl-1H-imidazol-4-yl)ethylidene]acrylohydrazide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H25N7O2
InChI InChI=1S/C33H25N7O2/c1-21-30(36-32(35-21)23-11-5-3-6-12-23)22(2)37-38-33(41)25(19-34)17-26-20-40(27-14-7-4-8-15-27)39-31(26)29-18-24-13-9-10-16-28(24)42-29/h3-18,20H,1-2H3,(H,35,36)(H,38,41)/b25-17+,37-22+
InChIKey OXKZYXSPCWQEAA-JPWVXYTOSA-N
Molecular Weight 551.610 g/mol
SMILES N(\N=C\(c1c([nH]c(n1)-c1ccccc1)C)C)C(\C(=C\c1c(n[n](-c2ccccc2)c1)-c1oc2ccccc2c1)C#N)=O
SPLASH splash10-0udi-0900030000-d3573c6cb44cc3f61509
Source of Spectrum F2-46-1510-14b
Wiley ID 1689522