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methyltartranonitrile, acetate (ester)

View entire compound with spectra: 5 NMR, 3 FTIR, and 3 MS (GC)

methyltartranonitrile, acetate (ester)
SpectraBase Compound ID JtwjxvUZpUT
InChI InChI=1S/C6H6N2O2/c1-5(9)10-6(2,3-7)4-8/h1-2H3
InChIKey OSNAAKXQIFQLNS-UHFFFAOYSA-N
Mol Weight 138.13 g/mol
Molecular Formula C6H6N2O2
Exact Mass 138.042927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6WQimubve7f
Name alpha,alpha-Dicyanoethyl acetate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 360953
CAS Registry Number 7790-01-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6N2O2
InChI InChI=1S/C6H6N2O2/c1-5(9)10-6(2,3-7)4-8/h1-2H3
InChIKey OSNAAKXQIFQLNS-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Acetoxy-alpha-methylmalononitrile; DAC
Wiley ID SIAL_1HNMR_007428