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1-(4-(Azidocarbonyl)phenyl)-3-((1,3-diphenyl-1H-pyrazol-4-yl)methylene)-5-phenyl-1H-pyrrol-2(3H)-one
SpectraBase Compound ID Glol75RmiMc
InChI InChI=1S/C33H22N6O2/c34-37-35-32(40)25-16-18-29(19-17-25)39-30(23-10-4-1-5-11-23)21-26(33(39)41)20-27-22-38(28-14-8-3-9-15-28)36-31(27)24-12-6-2-7-13-24/h1-22H
InChIKey FZHKELJJWAQEPI-UHFFFAOYSA-N
Mol Weight 534.6 g/mol
Molecular Formula C33H22N6O2
Exact Mass 534.180424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iKK946yYEj
Name 1-(4-(Azidocarbonyl)phenyl)-3-((1,3-diphenyl-1H-pyrazol-4-yl)methylene)-5-phenyl-1H-pyrrol-2(3H)-one
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H22N6O2
InChI InChI=1S/C33H22N6O2/c34-37-35-32(40)25-16-18-29(19-17-25)39-30(23-10-4-1-5-11-23)21-26(33(39)41)20-27-22-38(28-14-8-3-9-15-28)36-31(27)24-12-6-2-7-13-24/h1-22H
InChIKey FZHKELJJWAQEPI-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2456
Molecular Weight 534.579 g/mol
SMILES C(N=[N+]=[N-])(=O)c1ccc(cc1)N1C(C(C=C1c1ccccc1)=Cc1c(n[n](c1)-c1ccccc1)-c1ccccc1)=O
SPLASH splash10-0a4i-4907700000-27be5736964d5d477bd9
Source of Spectrum Y-53-1517-11
Wiley ID 1876618