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DVIPPHSQIBKWSA-UHFFFAOYSA-N
SpectraBase Compound ID KsmPGj1pKwl
InChI InChI=1S/C8H5ClO4/c9-4-1-2-5(7(10)11)6(3-4)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChIKey DVIPPHSQIBKWSA-UHFFFAOYSA-N
Mol Weight 200.58 g/mol
Molecular Formula C8H5ClO4
Exact Mass 199.987636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BcjuYfMzDEE
Name 4-CHLORPHTHALSAEURE
CAS Registry Number 89-20-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H5ClO4
InChI InChI=1S/C8H5ClO4/c9-4-1-2-5(7(10)11)6(3-4)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChIKey DVIPPHSQIBKWSA-UHFFFAOYSA-N
Literature Reference Author M.J.FIFOLT,S.A.SOJKA,R.A.WOLFE
Literature Reference Citation J.ORG.CHEM.,47,148(1982)
Literature Reference DOI 10.1021/jo00340a034
Molecular Weight 200.578 g/mol
Solvent DMSO-D6
Source File Reference UNIW18656