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3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile

View entire compound with spectra: 1 NMR

3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile
SpectraBase Compound ID 5dp6pCaJMcn
InChI InChI=1S/C12H13NO4/c1-15-10-6-8(9(14)4-5-13)7-11(16-2)12(10)17-3/h6-7H,4H2,1-3H3
InChIKey GFEMIDXDJDTTKQ-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I6Ql2uRrN1B
Name 3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.084457899 u
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-15-10-6-8(9(14)4-5-13)7-11(16-2)12(10)17-3/h6-7H,4H2,1-3H3
InChIKey GFEMIDXDJDTTKQ-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
NMR Offset 17.9887
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5544
Solvent CDCl3
Source Vendor ID: NMR/12668237