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trans-4-Chloro-3-nitrocinnamic acid

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trans-4-Chloro-3-nitrocinnamic acid
SpectraBase Compound ID 5tKJByOgFp
InChI InChI=1S/C9H6ClNO4/c10-7-3-1-6(2-4-9(12)13)5-8(7)11(14)15/h1-5H,(H,12,13)/b4-2+
InChIKey QBDALTIMHOITIU-DUXPYHPUSA-N
Mol Weight 227.6 g/mol
Molecular Formula C9H6ClNO4
Exact Mass 226.998535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7uUUTw1rAF6
Name trans-4-CHLORO-3-NITROCINNAMIC ACID
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 20797-48-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6ClNO4
InChI InChI=1S/C9H6ClNO4/c10-7-3-1-6(2-4-9(12)13)5-8(7)11(14)15/h1-5H,(H,12,13)/b4-2+
InChIKey QBDALTIMHOITIU-DUXPYHPUSA-N
Melting Point 187C
Molecular Weight 227.61
Solvent Polysol; Reference=TMS Spectrometer= Bruker AC-300
Synonyms CINNAMIC ACID, 4-CHLORO-3-NITRO-, trans-,