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Succinic acid, 2,4-dichlorophenethyl 2-methylhex-3-yl ester
SpectraBase Compound ID BoZgiVPuPur
InChI InChI=1S/C19H26Cl2O4/c1-4-5-17(13(2)3)25-19(23)9-8-18(22)24-11-10-14-6-7-15(20)12-16(14)21/h6-7,12-13,17H,4-5,8-11H2,1-3H3
InChIKey APTCTPMBIZUWPO-UHFFFAOYSA-N
Mol Weight 389.32 g/mol
Molecular Formula C19H26Cl2O4
Exact Mass 388.120815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2QoDePRe8yu
Name Succinic acid, 2,4-dichlorophenethyl 2-methylhex-3-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 388.120814713 u
Formula C19H26Cl2O4
InChI InChI=1S/C19H26Cl2O4/c1-4-5-17(13(2)3)25-19(23)9-8-18(22)24-11-10-14-6-7-15(20)12-16(14)21/h6-7,12-13,17H,4-5,8-11H2,1-3H3
InChIKey APTCTPMBIZUWPO-UHFFFAOYSA-N
Molecular Weight 389.319 g/mol
SMILES C(CCC(OCCC1=CC=C(C=C1Cl)Cl)=O)(OC(CCC)C(C)C)=O