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4-{4-[(1H-Pyrazol-1-yl)methyl]phenyl}benzenesulfonamide
SpectraBase Compound ID JIGjWD7jbc9
InChI InChI=1S/C16H15N3O2S/c17-22(20,21)16-8-6-15(7-9-16)14-4-2-13(3-5-14)12-19-11-1-10-18-19/h1-11H,12H2,(H2,17,20,21)
InChIKey ISHVKZQPCLEIEP-UHFFFAOYSA-N
Mol Weight 313.38 g/mol
Molecular Formula C16H15N3O2S
Exact Mass 313.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67Rm84Pz5vA
Name 4-{4-[(1H-Pyrazol-1-yl)methyl]phenyl}benzenesulfonamide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O2S
InChI InChI=1S/C16H15N3O2S/c17-22(20,21)16-8-6-15(7-9-16)14-4-2-13(3-5-14)12-19-11-1-10-18-19/h1-11H,12H2,(H2,17,20,21)
InChIKey ISHVKZQPCLEIEP-UHFFFAOYSA-N
Instrument Name GCT Waters
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.5b01771
Reported Formula C16H15N3O2S
SMILES NS(c1ccc(-c2ccc(C[n]3nccc3)cc2)cc1)(=O)=O
SPLASH splash10-03di-0339000000-be2c400ad7bda41cad4d
Source of Spectrum AF-59-727-4j
Wiley ID 1843792