John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7HY58qA2Q9H SpectraBase Spectrum ID=8KFH4sozpPL

(accessed ).
METHYL-5-CHLORO-2,4-DIHYDROXY-6-METHYLBENZOATE
SpectraBase Compound ID 7HY58qA2Q9H
InChI InChI=1S/C9H9ClO4/c1-4-7(9(13)14-2)5(11)3-6(12)8(4)10/h3,11-12H,1-2H3
InChIKey CZINJYZRJLWKLT-UHFFFAOYSA-N
Mol Weight 216.62 g/mol
Molecular Formula C9H9ClO4
Exact Mass 216.018937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KFH4sozpPL
Name METHYL-5-CHLORO-2,4-DIHYDROXY-6-METHYLBENZOATE
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9ClO4
InChI InChI=1S/C9H9ClO4/c1-4-7(9(13)14-2)5(11)3-6(12)8(4)10/h3,11-12H,1-2H3
InChIKey CZINJYZRJLWKLT-UHFFFAOYSA-N
Literature Reference Author D.M.X.DONNELLY,D.J.COVENEY,N.FUKUDA,J.POLONSKY
Literature Reference Citation J.NAT.PROD.,49,111(1986)
Literature Reference DOI 10.1021/np50043a013
Molecular Weight 216.621 g/mol
Solvent CDCl3
Source File Reference UWCS3903
SpectraBase Batch ID F3M6U36siCY