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Glutaric acid, 2,4,6-trichlorophenyl 2,4-dimethylpent-3-yl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4,6-trichlorophenyl 2,4-dimethylpent-3-yl ester
SpectraBase Compound ID 4RxmSgTq4q3
InChI InChI=1S/C18H23Cl3O4/c1-10(2)17(11(3)4)24-15(22)6-5-7-16(23)25-18-13(20)8-12(19)9-14(18)21/h8-11,17H,5-7H2,1-4H3
InChIKey SKAWSJJGEANSOY-UHFFFAOYSA-N
Mol Weight 409.74 g/mol
Molecular Formula C18H23Cl3O4
Exact Mass 408.066192 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AkxVwYtI321
Name Glutaric acid, 2,4,6-trichlorophenyl 2,4-dimethylpent-3-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 408.066192317 u
Formula C18H23Cl3O4
InChI InChI=1S/C18H23Cl3O4/c1-10(2)17(11(3)4)24-15(22)6-5-7-16(23)25-18-13(20)8-12(19)9-14(18)21/h8-11,17H,5-7H2,1-4H3
InChIKey SKAWSJJGEANSOY-UHFFFAOYSA-N
Molecular Weight 409.737 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC(C(C)C)C(C)C)=O