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1H-pyrazole-3-carbonitrile, 4-[2-[2-(ethylsulfonyl)phenyl]diazenyl]-4,5-dihydro-5-oxo-1-phenyl-
SpectraBase Compound ID 4ZhWOfOftXI
InChI InChI=1S/C18H15N5O3S/c1-2-27(25,26)16-11-7-6-10-14(16)20-21-17-15(12-19)22-23(18(17)24)13-8-4-3-5-9-13/h3-11,17H,2H2,1H3/b21-20+
InChIKey ORRBSSQJZWKPRX-QZQOTICOSA-N
Mol Weight 381.41 g/mol
Molecular Formula C18H15N5O3S
Exact Mass 381.089561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wHk5jcOWcB
Name 1H-pyrazole-3-carbonitrile, 4-[2-[2-(ethylsulfonyl)phenyl]diazenyl]-4,5-dihydro-5-oxo-1-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N5O3S
InChI InChI=1S/C18H15N5O3S/c1-2-27(25,26)16-11-7-6-10-14(16)20-21-17-15(12-19)22-23(18(17)24)13-8-4-3-5-9-13/h3-11,17H,2H2,1H3/b21-20+
InChIKey ORRBSSQJZWKPRX-QZQOTICOSA-N
Molecular Weight 381.410 g/mol
SMILES CCS(=O)(=O)c1ccccc1\N=N\C1C(=NN(C1=O)c1ccccc1)C#N
SPLASH splash10-01u0-9343000000-5f8fee576b1aeddd43fb
Source of Spectrum JX-2015-3-1711
Synonyms (E)-4-((2-(ethylsulfonyl)phenyl)diazenyl)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-3-carbonitrile
Wiley ID 1725183