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(Z)-2,4,5-TRICHLORO-3,3-ETHYLENEDIOXY-4-PENTENOIC_ACID
SpectraBase Compound ID 7eZ36U6rnRL
InChI InChI=1S/C7H7Cl3O4/c8-3-4(9)7(5(10)6(11)12)13-1-2-14-7/h3,5H,1-2H2,(H,11,12)/b4-3-
InChIKey WHHLHPDSTMOLQC-ARJAWSKDSA-N
Mol Weight 261.49 g/mol
Molecular Formula C7H7Cl3O4
Exact Mass 259.940992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 13tpHiFXiIw
Name (Z)-2,4,5-TRICHLORO-3,3-ETHYLENEDIOXY-4-PENTENOIC_ACID
Compound Number XV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7Cl3O4
InChI InChI=1S/C7H7Cl3O4/c8-3-4(9)7(5(10)6(11)12)13-1-2-14-7/h3,5H,1-2H2,(H,11,12)/b4-3-
InChIKey WHHLHPDSTMOLQC-ARJAWSKDSA-N
Literature Reference Author R.R.AKHMETVALEEV,G.A.SHAVALEEVA,N.A.IVANOVA,M.S.MIFTAKHOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,1493(2003)
Literature Reference DOI 10.1023/B:RUJO.0000010568.07788.3d
Molecular Weight 261.489 g/mol
Solvent CDCl3
Source File Reference UWMZ23262