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Cyanoacetic acid, methyl ester

View entire compound with spectra: 21 NMR, 10 FTIR, 1 Raman, 7 MS (GC), and 2 Near IR

Cyanoacetic acid, methyl ester
SpectraBase Compound ID DSg9OtsIARl
InChI InChI=1S/C4H5NO2/c1-7-4(6)2-3-5/h2H2,1H3
InChIKey ANGDWNBGPBMQHW-UHFFFAOYSA-N
Mol Weight 99.09 g/mol
Molecular Formula C4H5NO2
Exact Mass 99.032028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9h9cRBf8zhs
Name Cyanoacetic acid, methyl ester
CAS Registry Number 105-34-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H5NO2
InChI InChI=1S/C4H5NO2/c1-7-4(6)2-3-5/h2H2,1H3
InChIKey ANGDWNBGPBMQHW-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference V. Machacek, V. Sterba, A. Lycka, J. Chem. Soc. Perkin II 355 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6