John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=12ZdvxrfMNg SpectraBase Spectrum ID=1M9oLuJNcQ5

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p-(isopropylsulfonyl)-N-[(3,4-(methylenedioxy)phenethyl]benzamide
SpectraBase Compound ID 12ZdvxrfMNg
InChI InChI=1S/C19H21NO5S/c1-13(2)26(22,23)16-6-4-15(5-7-16)19(21)20-10-9-14-3-8-17-18(11-14)25-12-24-17/h3-8,11,13H,9-10,12H2,1-2H3,(H,20,21)
InChIKey ZEADYDVSCVEYJF-UHFFFAOYSA-N
Mol Weight 375.44 g/mol
Molecular Formula C19H21NO5S
Exact Mass 375.114045 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1M9oLuJNcQ5
Name p-(ISOPROPYLSULFONYL)-N-[3,4-(METHYLENEDIOXY)PHENETHYL]BENZAMIDE
Source of Sample M. S. Chodnekar, F. Hoffmann-La Roche & Company Ltd., Basel, Switzerland
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Formula C19H21NO5S
InChI InChI=1S/C19H21NO5S/c1-13(2)26(22,23)16-6-4-15(5-7-16)19(21)20-10-9-14-3-8-17-18(11-14)25-12-24-17/h3-8,11,13H,9-10,12H2,1-2H3,(H,20,21)
InChIKey ZEADYDVSCVEYJF-UHFFFAOYSA-N
Melting Point 145-147C
Molecular Weight 375.45
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
SpectraBase Batch ID 7fqkfdCu20Y
Synonyms BENZAMIDE, P-/ISOPROPYLSULFONYL/-N- /3,4-/METHYLENEDIOXY/PHENETHYL/-,