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5-(furan-2-yl)-3-(3-methyl-5-oxo-4-(2-phenylhydrazono)-4,5-dihydro-1H-pyrazole-1-carbonyl)-1-phenyl-1H-pyrazole-4-carbonitrile

View entire compound with spectra: 1 MS (GC)

5-(furan-2-yl)-3-(3-methyl-5-oxo-4-(2-phenylhydrazono)-4,5-dihydro-1H-pyrazole-1-carbonyl)-1-phenyl-1H-pyrazole-4-carbonitrile
SpectraBase Compound ID La7UvhnUSKN
InChI InChI=1S/C25H17N7O3/c1-16-21(28-27-17-9-4-2-5-10-17)24(33)32(29-16)25(34)22-19(15-26)23(20-13-8-14-35-20)31(30-22)18-11-6-3-7-12-18/h2-14,27H,1H3
InChIKey SHMQYNROGNYSCZ-UHFFFAOYSA-N
Mol Weight 463.46 g/mol
Molecular Formula C25H17N7O3
Exact Mass 463.139287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D202hv9jKw2
Name 5-(furan-2-yl)-3-(3-methyl-5-oxo-4-(2-phenylhydrazono)-4,5-dihydro-1H-pyrazole-1-carbonyl)-1-phenyl-1H-pyrazole-4-carbonitrile
Alternate Name(s) 5-(furan-2-yl)-3-(3-methyl-5-oxo-4-(2-phenylhydrazineylidene)-4,5-dihydro-1H-pyrazole-1-carbonyl)-1-phenyl-1H-pyrazole-4-carbonitrile
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Formula C25H17N7O3
InChI InChI=1S/C25H17N7O3/c1-16-21(28-27-17-9-4-2-5-10-17)24(33)32(29-16)25(34)22-19(15-26)23(20-13-8-14-35-20)31(30-22)18-11-6-3-7-12-18/h2-14,27H,1H3
InChIKey SHMQYNROGNYSCZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200600116
Molecular Weight 463.457 g/mol
SMILES N(N=C1C(=NN(C(c2n[n](c(c2C#N)-c2occc2)-c2ccccc2)=O)C1=O)C)c1ccccc1
SPLASH splash10-0hk9-9130000000-f6baefab434a1128fd22
Source of Spectrum QA-53-877-8a
Wiley ID 1796215