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4-{[(2',2'-Dimethyl-1',3'-dioxolan-4'-yl)methylene]amino}-N-(1"-phenyl-1H-pyrazol-3"-yl)-benzenesulfonamide
SpectraBase Compound ID HQuSa5DVPFs
InChI InChI=1S/C21H22N4O4S/c1-21(2)28-15-18(29-21)14-22-16-8-10-19(11-9-16)30(26,27)24-20-12-13-25(23-20)17-6-4-3-5-7-17/h3-14,18H,15H2,1-2H3,(H,23,24)/b22-14+
InChIKey YJCANXTXSYQPFT-HYARGMPZSA-N
Mol Weight 426.49 g/mol
Molecular Formula C21H22N4O4S
Exact Mass 426.136176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ilp5Gvux4LA
Name 4-{[(2',2'-Dimethyl-1',3'-dioxolan-4'-yl)methylene]amino}-N-(1"-phenyl-1H-pyrazol-3"-yl)-benzenesulfonamide
Alternate Name(s) 4-{[(2',2'-Dimethyl-1',3'-dioxolan-4'-yl)methylene]amino}-N-(1''-phenyl-1H-pyrazol-3''-yl)-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N4O4S
InChI InChI=1S/C21H22N4O4S/c1-21(2)28-15-18(29-21)14-22-16-8-10-19(11-9-16)30(26,27)24-20-12-13-25(23-20)17-6-4-3-5-7-17/h3-14,18H,15H2,1-2H3,(H,23,24)/b22-14+
InChIKey YJCANXTXSYQPFT-HYARGMPZSA-N
Molecular Weight 426.491 g/mol
SMILES N(S(c1ccc(\N=C\C2OC(C)(C)OC2)cc1)(=O)=O)c1n[n](-c2ccccc2)cc1
SPLASH splash10-004i-7940000000-11dca496bb4e958fddfb
Source of Spectrum SK-30-2475-(R,S)-1(d)
Wiley ID 881354