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1,1'-(Biphenyl-4,4'-diyl)bis(3-acetyl-5-amino-1H-pyrazole-4-carboxamide)
SpectraBase Compound ID GdnRbZ4eaBZ
InChI InChI=1S/C24H22N8O4/c1-11(33)19-17(23(27)35)21(25)31(29-19)15-7-3-13(4-8-15)14-5-9-16(10-6-14)32-22(26)18(24(28)36)20(30-32)12(2)34/h3-10H,25-26H2,1-2H3,(H2,27,35)(H2,28,36)
InChIKey RUWVTFGNBRHYMJ-UHFFFAOYSA-N
Mol Weight 486.49 g/mol
Molecular Formula C24H22N8O4
Exact Mass 486.176401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bXVrSy1dA
Name 1,1'-(Biphenyl-4,4'-diyl)bis(3-acetyl-5-amino-1H-pyrazole-4-carboxamide)
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N8O4
InChI InChI=1S/C24H22N8O4/c1-11(33)19-17(23(27)35)21(25)31(29-19)15-7-3-13(4-8-15)14-5-9-16(10-6-14)32-22(26)18(24(28)36)20(30-32)12(2)34/h3-10H,25-26H2,1-2H3,(H2,27,35)(H2,28,36)
InChIKey RUWVTFGNBRHYMJ-UHFFFAOYSA-N
Instrument Name Shimadzu-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2013.11.040
Molecular Weight 486.492 g/mol
SMILES Nc1c(c(n[n]1-c1ccc(-c2ccc(-[n]3nc(c(C(N)=O)c3N)C(C)=O)cc2)cc1)C(C)=O)C(N)=O
SPLASH splash10-053f-0897000000-dcc878580bbaa20fa4ea
Source of Spectrum AJC-10-S3008-4b
Wiley ID 1857209