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Butanoic acid, 4-[[2-(4-morpholinylsulfonyl)ethyl](2-pyridinylmethyl)amino]-4-oxo-
SpectraBase Compound ID GtZefwMJm6u
InChI InChI=1S/C16H23N3O6S/c20-15(4-5-16(21)22)18(13-14-3-1-2-6-17-14)9-12-26(23,24)19-7-10-25-11-8-19/h1-3,6H,4-5,7-13H2,(H,21,22)
InChIKey WVIYHUYRFMSGKF-UHFFFAOYSA-N
Mol Weight 385.44 g/mol
Molecular Formula C16H23N3O6S
Exact Mass 385.130757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COfn2XqkhL3
Name Butanoic acid, 4-[[2-(4-morpholinylsulfonyl)ethyl](2-pyridinylmethyl)amino]-4-oxo-
Comments Computed using HOSE algorithm
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Exact Mass 385.130756641 u
Formula C16H23N3O6S
InChI InChI=1S/C16H23N3O6S/c20-15(4-5-16(21)22)18(13-14-3-1-2-6-17-14)9-12-26(23,24)19-7-10-25-11-8-19/h1-3,6H,4-5,7-13H2,(H,21,22)
InChIKey WVIYHUYRFMSGKF-UHFFFAOYSA-N
Molecular Weight 385.435 g/mol
SMILES OC(CCC(N(CCS(N1CCOCC1)(=O)=O)CC1=NC=CC=C1)=O)=O