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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 5GZFGOBQhS4
Name trans-5-BROMO-2-NITRO-3-THIOPHENEACRYLIC ACID, METHYL ESTER
Source of Sample S. Gronowitz, I. Ander Chem. Scripta 15, 145 (1980)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Molecular Weight 292.11
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Jeol FX-60
Synonyms 3-THIOPHENEACRYLIC ACID, 5-BROMO- 2-NITRO-, METHYL ESTER, trans-,