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2-propenoic acid, 2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-, methyl ester, (2Z)-
SpectraBase Compound ID 9hogkp1XQyT
InChI InChI=1S/C13H11NO5/c1-16-10-4-8(3-9(6-14)13(15)17-2)5-11-12(10)19-7-18-11/h3-5H,7H2,1-2H3/b9-3-
InChIKey YWGFLCBQBVTKRP-OQFOIZHKSA-N
Mol Weight 261.23 g/mol
Molecular Formula C13H11NO5
Exact Mass 261.063722 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7mJgiLuHoL8
Name 2-propenoic acid, 2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-, methyl ester, (2Z)-
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/C13H11NO5/c1-16-10-4-8(3-9(6-14)13(15)17-2)5-11-12(10)19-7-18-11/h3-5H,7H2,1-2H3/b9-3-
InChIKey YWGFLCBQBVTKRP-OQFOIZHKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4955
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/17211246; Labnumber: TSH-703/0681