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N-(tert-Butyl)-2-[(phenylmethyl)sulfonamido]-4-(trifluoromethyl)benzamide
SpectraBase Compound ID GMDdIziVIix
InChI InChI=1S/C19H21F3N2O3S/c1-18(2,3)23-17(25)15-10-9-14(19(20,21)22)11-16(15)24-28(26,27)12-13-7-5-4-6-8-13/h4-11,24H,12H2,1-3H3,(H,23,25)
InChIKey AZMCROQCYGSDDV-UHFFFAOYSA-N
Mol Weight 414.44 g/mol
Molecular Formula C19H21F3N2O3S
Exact Mass 414.122498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qB7OaTeWIN
Name N-(tert-Butyl)-2-[(phenylmethyl)sulfonamido]-4-(trifluoromethyl)benzamide
Appearance White solid
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Exact Mass 414.122498204 u
Formula C19H21F3N2O3S
InChI InChI=1S/C19H21F3N2O3S/c1-18(2,3)23-17(25)15-10-9-14(19(20,21)22)11-16(15)24-28(26,27)12-13-7-5-4-6-8-13/h4-11,24H,12H2,1-3H3,(H,23,25)
InChIKey AZMCROQCYGSDDV-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/anie.201511689
Molecular Weight 414.443 g/mol
Quality 159
Reported Formula C19H21O3N2F3S
SMILES N(C=1C=C(C=CC1C(=O)NC(C)(C)C)C(F)(F)F)S(=O)(=O)CC1=CC=CC=C1
SPLASH splash10-0006-9070300000-dd2e7aed69096a2df524
Source of Spectrum ACI-55-SM7-3o (DOI: 10.1002/anie.201511689)
Wiley ID 1895212