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N-(Benzyl)-N???-(p-methylbenzenesulfonyl)-p-toluenesulfonimidamide
SpectraBase Compound ID 5kimabNlrDu
InChI InChI=1S/C21H22N2O3S2/c1-17-8-12-20(13-9-17)27(24,22-16-19-6-4-3-5-7-19)23-28(25,26)21-14-10-18(2)11-15-21/h3-15H,16H2,1-2H3,(H,22,23,24)
InChIKey KNUMBTSYYAQLRW-UHFFFAOYSA-N
Mol Weight 414.54 g/mol
Molecular Formula C21H22N2O3S2
Exact Mass 414.107185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cUgdVyrQYI
Name N-(Benzyl)-N???-(p-methylbenzenesulfonyl)-p-toluenesulfonimidamide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.107184921 u
Formula C21H22N2O3S2
InChI InChI=1S/C21H22N2O3S2/c1-17-8-12-20(13-9-17)27(24,22-16-19-6-4-3-5-7-19)23-28(25,26)21-14-10-18(2)11-15-21/h3-15H,16H2,1-2H3,(H,22,23,24)
InChIKey KNUMBTSYYAQLRW-UHFFFAOYSA-N
Instrument Name Varian MAT 212
Ionization Type EI
Literature Reference DOI 10.1186/1860-5397-3-25
Molecular Weight 414.538 g/mol
Quality 29
SMILES N(S(=NS(C1=CC=C(C)C=C1)(=O)=O)(C1=CC=C(C=C1)C)=O)CC1=CC=CC=C1
SPLASH splash10-0a4i-0900000000-9edb4c4e040ac54884d1
Source of Spectrum BJO-3-SM2-3b (DOI: 10.1186/1860-5397-3-25)
Wiley ID 1908957