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benzoic acid, 4-methyl-3-[(4-methyl-1-piperidinyl)sulfonyl]-, 8-quinolinyl ester
SpectraBase Compound ID Cx0BvKYWgN6
InChI InChI=1S/C23H24N2O4S/c1-16-10-13-25(14-11-16)30(27,28)21-15-19(9-8-17(21)2)23(26)29-20-7-3-5-18-6-4-12-24-22(18)20/h3-9,12,15-16H,10-11,13-14H2,1-2H3
InChIKey GNFAOYYFZTWTRA-UHFFFAOYSA-N
Mol Weight 424.52 g/mol
Molecular Formula C23H24N2O4S
Exact Mass 424.145678 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K4MD2WXe9OL
Name benzoic acid, 4-methyl-3-[(4-methyl-1-piperidinyl)sulfonyl]-, 8-quinolinyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.145678431 u
Formula C23H24N2O4S
InChI InChI=1S/C23H24N2O4S/c1-16-10-13-25(14-11-16)30(27,28)21-15-19(9-8-17(21)2)23(26)29-20-7-3-5-18-6-4-12-24-22(18)20/h3-9,12,15-16H,10-11,13-14H2,1-2H3
InChIKey GNFAOYYFZTWTRA-UHFFFAOYSA-N
Molecular Weight 424.515 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_883
Solvent DMSO-d6
Source Vendor ID: ZI/8108918; Lab Info: SP; Lab Number: SP-0002324