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(1-(2-(Methylsulfonamido)ethyl)piperidin-4-yl)methyl 1-methyl-1H-indole-3-carboxylate
SpectraBase Compound ID 99l5rjFG6Ee
InChI InChI=1S/C19H27N3O4S/c1-21-13-17(16-5-3-4-6-18(16)21)19(23)26-14-15-7-10-22(11-8-15)12-9-20-27(2,24)25/h3-6,13,15,20H,7-12,14H2,1-2H3
InChIKey MOZPSIXKYJUTKI-UHFFFAOYSA-N
Mol Weight 393.5 g/mol
Molecular Formula C19H27N3O4S
Exact Mass 393.172228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6nhAAg5VdJj
Name (1-(2-(Methylsulfonamido)ethyl)piperidin-4-yl)methyl 1-methyl-1H-indole-3-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 393.172227531 u
Formula C19H27N3O4S
InChI InChI=1S/C19H27N3O4S/c1-21-13-17(16-5-3-4-6-18(16)21)19(23)26-14-15-7-10-22(11-8-15)12-9-20-27(2,24)25/h3-6,13,15,20H,7-12,14H2,1-2H3
InChIKey MOZPSIXKYJUTKI-UHFFFAOYSA-N
Molecular Weight 393.502 g/mol
SMILES C=1N(C2=C(C1C(=O)OCC1CCN(CC1)CCNS(=O)(=O)C)C=CC=C2)C