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Cyanoacetic acid

View entire compound with spectra: 12 NMR, 5 FTIR, 2 Raman, and 4 MS (GC)

Cyanoacetic acid
SpectraBase Compound ID 66vXuumuB13
InChI InChI=1S/C3H3NO2/c4-2-1-3(5)6/h1H2,(H,5,6)
InChIKey MLIREBYILWEBDM-UHFFFAOYSA-N
Mol Weight 85.062 g/mol
Molecular Formula C3H3NO2
Exact Mass 85.016378 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7i3iaTOYSBe
Name Cyanoacetic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number C88505
CAS Registry Number 372-09-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H3NO2
InChI InChI=1S/C3H3NO2/c4-2-1-3(5)6/h1H2,(H,5,6)
InChIKey MLIREBYILWEBDM-UHFFFAOYSA-N
Observed nucleus 1H
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_011166