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N-(3',4'-Methylenedioxyphenyl)-2,5-dimethyl-N-toluene-p-sulfonyl)aniline
SpectraBase Compound ID BrEw5qUwtva
InChI InChI=1S/C22H21NO4S/c1-15-5-9-19(10-6-15)28(24,25)23(20-12-16(2)4-7-17(20)3)18-8-11-21-22(13-18)27-14-26-21/h4-13H,14H2,1-3H3
InChIKey AAOHCWBOLQCXCX-UHFFFAOYSA-N
Mol Weight 395.47 g/mol
Molecular Formula C22H21NO4S
Exact Mass 395.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GL1ZoSq8mp9
Name N-(3',4'-Methylenedioxyphenyl)-2,5-dimethyl-N-toluene-p-sulfonyl)aniline
Alternate Name(s) N-(1,3-benzodioxol-5-yl)-N-(2,5-dimethylphenyl)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO4S
InChI InChI=1S/C22H21NO4S/c1-15-5-9-19(10-6-15)28(24,25)23(20-12-16(2)4-7-17(20)3)18-8-11-21-22(13-18)27-14-26-21/h4-13H,14H2,1-3H3
InChIKey AAOHCWBOLQCXCX-UHFFFAOYSA-N
Molecular Weight 395.473 g/mol
SMILES c1(N(S(c2ccc(cc2)C)(=O)=O)c2cc3OCOc3cc2)c(ccc(c1)C)C
SPLASH splash10-01po-0392000000-d02937ff5dd762b89c38
Source of Spectrum KC-1992-3444-3
Wiley ID 777864