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[{[5-(Dimethylamino)-1-naphthyl]sulfonyl}(methyl)amino]acetic acid, methyl ester
SpectraBase Compound ID 52ymB5gIEFJ
InChI InChI=1S/C16H20N2O4S/c1-17(2)14-9-5-8-13-12(14)7-6-10-15(13)23(20,21)18(3)11-16(19)22-4/h5-10H,11H2,1-4H3
InChIKey KNJCJHVQNSZHLT-UHFFFAOYSA-N
Mol Weight 336.41 g/mol
Molecular Formula C16H20N2O4S
Exact Mass 336.114378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DT6bIlFHWmG
Name [{[5-(Dimethylamino)-1-naphthyl]sulfonyl}(methyl)amino]acetic acid, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.114378302 u
Formula C16H20N2O4S
InChI InChI=1S/C16H20N2O4S/c1-17(2)14-9-5-8-13-12(14)7-6-10-15(13)23(20,21)18(3)11-16(19)22-4/h5-10H,11H2,1-4H3
InChIKey KNJCJHVQNSZHLT-UHFFFAOYSA-N
Molecular Weight 336.406 g/mol
SMILES C(CN(C)S(=O)(=O)C1=CC=CC=2C1=CC=CC2N(C)C)(=O)OC