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4-AZA-2-CYANO-5-DIMETHYLAMINO-2E,4E-PENTADIENOIC ACID, METHYL ESTER
SpectraBase Compound ID GvC172VswF9
InChI InChI=1S/C8H11N3O2/c1-11(2)6-10-5-7(4-9)8(12)13-3/h5-6H,1-3H3/b7-5+,10-6+
InChIKey CQNNAZDQLRTWOE-YLNKAEQOSA-N
Mol Weight 181.19 g/mol
Molecular Formula C8H11N3O2
Exact Mass 181.085127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LyDueAwbsQ6
Name 4-AZA-2-CYANO-5-DIMETHYLAMINO-2E,4E-PENTADIENOIC ACID, METHYL ESTER
Comments ##
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H11N3O2
InChI InChI=1S/C8H11N3O2/c1-11(2)6-10-5-7(4-9)8(12)13-3/h5-6H,1-3H3/b7-5+,10-6+
InChIKey CQNNAZDQLRTWOE-YLNKAEQOSA-N
Instrument Name Bruker AM-300
Literature Reference ZH.A.KRASNAYA, V.S.BOGDANOV (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N10, 2348-2356.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D3N acetonitrile-d