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Glycine, N-[[2-[2-(3-cyano-4,5-dihydro-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]phenyl]sulfonyl]-
SpectraBase Compound ID 31mWyeyMo7N
InChI InChI=1S/C18H14N6O5S/c19-10-14-17(18(27)24(23-14)12-6-2-1-3-7-12)22-21-13-8-4-5-9-15(13)30(28,29)20-11-16(25)26/h1-9,17,20H,11H2,(H,25,26)/b22-21-
InChIKey FUTRYGGBRFGEPY-DQRAZIAOSA-N
Mol Weight 426.41 g/mol
Molecular Formula C18H14N6O5S
Exact Mass 426.074639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Xgo1ArIUOm
Name Glycine, N-[[2-[2-(3-cyano-4,5-dihydro-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]phenyl]sulfonyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N6O5S
InChI InChI=1S/C18H14N6O5S/c19-10-14-17(18(27)24(23-14)12-6-2-1-3-7-12)22-21-13-8-4-5-9-15(13)30(28,29)20-11-16(25)26/h1-9,17,20H,11H2,(H,25,26)/b22-21-
InChIKey FUTRYGGBRFGEPY-DQRAZIAOSA-N
Molecular Weight 426.407 g/mol
SMILES OC(CNS(=O)(=O)c1ccccc1\N=N/C1C(=O)N(N=C1C#N)c1ccccc1)=O
SPLASH splash10-004i-9300000000-4e0d6808a14a9cd3bb0b
Source of Spectrum JX-2015-4-343
Synonyms 2-(2-((3-cyano-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl)phenylsulfonamido)acetic acid
Wiley ID 1725786