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2,2,2-TRICHLORO-1,1-DIMETHYLETHYL-4-METHYLBENZOATE

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2,2,2-TRICHLORO-1,1-DIMETHYLETHYL-4-METHYLBENZOATE
SpectraBase Compound ID 8NucmnbDvUr
InChI InChI=1S/C12H13Cl3O2/c1-8-4-6-9(7-5-8)10(16)17-11(2,3)12(13,14)15/h4-7H,1-3H3
InChIKey BNODPOBOSDBCQO-UHFFFAOYSA-N
Mol Weight 295.59 g/mol
Molecular Formula C12H13Cl3O2
Exact Mass 293.998113 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbXCEoSycCc
Name 2,2,2-TRICHLORO-1,1-DIMETHYLETHYL-4-METHYLBENZOATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13Cl3O2
InChI InChI=1S/C12H13Cl3O2/c1-8-4-6-9(7-5-8)10(16)17-11(2,3)12(13,14)15/h4-7H,1-3H3
InChIKey BNODPOBOSDBCQO-UHFFFAOYSA-N
Literature Reference Author L.KOVACS,P.FORG,Z.KELE
Literature Reference Citation MOLBANK,M379(2004)
Molecular Weight 295.593 g/mol
Solvent CDCl3
Source File Reference UWPA1439