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Glutaric acid, propyl 2,2,2-trichloroethyl ester
SpectraBase Compound ID 1jBU7GOlEB6
InChI InChI=1S/C10H15Cl3O4/c1-2-6-16-8(14)4-3-5-9(15)17-7-10(11,12)13/h2-7H2,1H3
InChIKey UROAVZJBMWMIEJ-UHFFFAOYSA-N
Mol Weight 305.59 g/mol
Molecular Formula C10H15Cl3O4
Exact Mass 304.003592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F3vhUwt2bKf
Name Glutaric acid, propyl 2,2,2-trichloroethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 304.003592059 u
Formula C10H15Cl3O4
InChI InChI=1S/C10H15Cl3O4/c1-2-6-16-8(14)4-3-5-9(15)17-7-10(11,12)13/h2-7H2,1H3
InChIKey UROAVZJBMWMIEJ-UHFFFAOYSA-N
Molecular Weight 305.585 g/mol
SMILES CCCOC(CCCC(OCC(Cl)(Cl)Cl)=O)=O