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Benzoic acid, 4-[2-(3-cyano-2,5-dihydro-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-
SpectraBase Compound ID GnvtoFo1W79
InChI InChI=1S/C17H11N5O3/c18-10-14-15(16(23)22(21-14)13-4-2-1-3-5-13)20-19-12-8-6-11(7-9-12)17(24)25/h1-9,21H,(H,24,25)/b20-19+
InChIKey MWXXDQUTTHONSA-FMQUCBEESA-N
Mol Weight 333.31 g/mol
Molecular Formula C17H11N5O3
Exact Mass 333.086189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NkkIcH63dx
Name Benzoic acid, 4-[2-(3-cyano-2,5-dihydro-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-
Alternate Name(s) (E)-4-((5-cyano-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11N5O3
InChI InChI=1S/C17H11N5O3/c18-10-14-15(16(23)22(21-14)13-4-2-1-3-5-13)20-19-12-8-6-11(7-9-12)17(24)25/h1-9,21H,(H,24,25)/b20-19+
InChIKey MWXXDQUTTHONSA-FMQUCBEESA-N
Molecular Weight 333.307 g/mol
SMILES OC(c1ccc(\N=N\C2=C(C#N)NN(C2=O)c2ccccc2)cc1)=O
SPLASH splash10-01u0-9212000000-2d38a9ca417de3364891
Source of Spectrum JX-2015-3-618
Wiley ID 1724166