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2-propen-1-one, 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(3-thienyl)-, (2E)-

View entire compound with spectra: 1 NMR

2-propen-1-one, 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(3-thienyl)-, (2E)-
SpectraBase Compound ID KT1lRkc6soB
InChI InChI=1S/C16H14O5S/c1-18-13-7-10(3-4-12(17)11-5-6-22-8-11)14(19-2)16-15(13)20-9-21-16/h3-8H,9H2,1-2H3/b4-3+
InChIKey YSJXEKGPUQUXJY-ONEGZZNKSA-N
Mol Weight 318.34 g/mol
Molecular Formula C16H14O5S
Exact Mass 318.056195 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ZnGG6b8gNO
Name 2-propen-1-one, 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(3-thienyl)-, (2E)-
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/C16H14O5S/c1-18-13-7-10(3-4-12(17)11-5-6-22-8-11)14(19-2)16-15(13)20-9-21-16/h3-8H,9H2,1-2H3/b4-3+
InChIKey YSJXEKGPUQUXJY-ONEGZZNKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4989
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: NMR/17311053; Labnumber: TSH-712/0200