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META-NITRO-ETHYL-(E)-(ALPHA-CYANO)-CINNAMATE
SpectraBase Compound ID I6xNmcuIcCh
InChI InChI=1S/C12H10N2O4/c1-2-18-12(15)10(8-13)6-9-4-3-5-11(7-9)14(16)17/h3-7H,2H2,1H3/b10-6+
InChIKey BUEJQBJZGAURKT-UXBLZVDNSA-N
Mol Weight 246.22 g/mol
Molecular Formula C12H10N2O4
Exact Mass 246.064057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GhSBBVSd0vI
Name A-Cyano-3-nitro-cinnamic acid, ethyl ester
CAS Registry Number 18925-00-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H10N2O4
InChI InChI=1S/C12H10N2O4/c1-2-18-12(15)10(8-13)6-9-4-3-5-11(7-9)14(16)17/h3-7H,2H2,1H3/b10-6+
InChIKey BUEJQBJZGAURKT-UXBLZVDNSA-N
Instrument Name Bruker WP-80
Literature Reference F.A. Bottino, G. Musumarra, Z. Rappoport, Magn. Res. Chem. 24, 31 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6