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N-(3-Hydroxyphenyl)-3-(toluene-4-sulfonylamino) propionamide

View entire compound with spectra: 1 NMR

N-(3-Hydroxyphenyl)-3-(toluene-4-sulfonylamino) propionamide
SpectraBase Compound ID 2FMh5GYkmjN
InChI InChI=1S/C16H18N2O4S/c1-12-5-7-15(8-6-12)23(21,22)17-10-9-16(20)18-13-3-2-4-14(19)11-13/h2-8,11,17,19H,9-10H2,1H3,(H,18,20)
InChIKey MIZKGYHNKIYJFG-UHFFFAOYSA-N
Mol Weight 334.39 g/mol
Molecular Formula C16H18N2O4S
Exact Mass 334.098728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8M7czXvZk9y
Name N-(3-Hydroxyphenyl)-3-(toluene-4-sulfonylamino) propionamide
Comments Computed using HOSE algorithm
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Exact Mass 334.098728238 u
Formula C16H18N2O4S
InChI InChI=1S/C16H18N2O4S/c1-12-5-7-15(8-6-12)23(21,22)17-10-9-16(20)18-13-3-2-4-14(19)11-13/h2-8,11,17,19H,9-10H2,1H3,(H,18,20)
InChIKey MIZKGYHNKIYJFG-UHFFFAOYSA-N
Molecular Weight 334.390 g/mol
SMILES C1=C(C=CC(=C1)S(NCCC(NC1=CC(=CC=C1)O)=O)(=O)=O)C