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acetamide, N-[(1S)-1-(hydroxymethyl)-3-(methylthio)propyl]-2-[(2-oxo-3-phenyl-2H-1-benzopyran-7-yl)oxy]-
SpectraBase Compound ID 57MN5bhxB72
InChI InChI=1S/C22H23NO5S/c1-29-10-9-17(13-24)23-21(25)14-27-18-8-7-16-11-19(15-5-3-2-4-6-15)22(26)28-20(16)12-18/h2-8,11-12,17,24H,9-10,13-14H2,1H3,(H,23,25)
InChIKey SDMJBHRFQZHVJE-UHFFFAOYSA-N
Mol Weight 413.49 g/mol
Molecular Formula C22H23NO5S
Exact Mass 413.129694 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EtpsoEvt4Ry
Name acetamide, N-[(1S)-1-(hydroxymethyl)-3-(methylthio)propyl]-2-[(2-oxo-3-phenyl-2H-1-benzopyran-7-yl)oxy]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H23NO5S/c1-29-10-9-17(13-24)23-21(25)14-27-18-8-7-16-11-19(15-5-3-2-4-6-15)22(26)28-20(16)12-18/h2-8,11-12,17,24H,9-10,13-14H2,1H3,(H,23,25)
InChIKey SDMJBHRFQZHVJE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9317
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F34842; Labnumber: ExLab-259037