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CSRJYVIKHJFLSA-UHFFFAOYSA-N

View entire compound with spectra: 3 NMR, and 1 MS (GC)

CSRJYVIKHJFLSA-UHFFFAOYSA-N
SpectraBase Compound ID Jdrc4Utd0jH
InChI InChI=1S/C17H14Cl2O7/c1-6-4-8(5-9(20)10(6)16(23)25-3)26-17(24)11-7(2)12(18)15(22)13(19)14(11)21/h4-5,20-22H,1-3H3
InChIKey CSRJYVIKHJFLSA-UHFFFAOYSA-N
Mol Weight 401.2 g/mol
Molecular Formula C17H14Cl2O7
Exact Mass 400.011658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6qgz8HSUe1A
Name METHYL-3,5-DICHLOR-LECANORAT
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14Cl2O7
InChI InChI=1S/C17H14Cl2O7/c1-6-4-8(5-9(20)10(6)16(23)25-3)26-17(24)11-7(2)12(18)15(22)13(19)14(11)21/h4-5,20-22H,1-3H3
InChIKey CSRJYVIKHJFLSA-UHFFFAOYSA-N
Literature Reference Author E.G.SUNDHOLM,S.HUNECK
Literature Reference Citation CHEM.SCRIPTA,16,197(1980)
Molecular Weight 401.200 g/mol
Solvent DMSO-D6
Source File Reference UNIW16893