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trans-5-BROMO-2-NITRO-3-THIOPHENEACRYLIC ACID, METHYL ESTER
SpectraBase Compound ID 4W5LOHEARPQ
InChI InChI=1S/C8H6BrNO4S/c1-14-7(11)3-2-5-4-6(9)15-8(5)10(12)13/h2-4H,1H3/b3-2+
InChIKey OKOQQTYPULZYFL-NSCUHMNNSA-N
Mol Weight 292.1 g/mol
Molecular Formula C8H6BrNO4S
Exact Mass 290.920092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KwKGOjMpWLQ
Name trans-3-(5-Bromo-2-nitro-3-thienyl)-acrylic acid, methyl ester
CAS Registry Number 75754-88-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H6BrNO4S
InChI InChI=1S/C8H6BrNO4S/c1-14-7(11)3-2-5-4-6(9)15-8(5)10(12)13/h2-4H,1H3/b3-2+
InChIKey OKOQQTYPULZYFL-NSCUHMNNSA-N
Instrument Name Jeol FX-60
Literature Reference S. Gronowitz, I. Ander, Chemica Scripta 15, 145 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3