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Succinic acid, 10-chlorodecyl pentyl ester
SpectraBase Compound ID 7mmpubRfyW5
InChI InChI=1S/C19H35ClO4/c1-2-3-11-16-23-18(21)13-14-19(22)24-17-12-9-7-5-4-6-8-10-15-20/h2-17H2,1H3
InChIKey JSJJXPMDQXRCDP-UHFFFAOYSA-N
Mol Weight 362.9 g/mol
Molecular Formula C19H35ClO4
Exact Mass 362.222387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eHU7npkt9a
Name Succinic acid, 10-chlorodecyl pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 362.222387303 u
Formula C19H35ClO4
InChI InChI=1S/C19H35ClO4/c1-2-3-11-16-23-18(21)13-14-19(22)24-17-12-9-7-5-4-6-8-10-15-20/h2-17H2,1H3
InChIKey JSJJXPMDQXRCDP-UHFFFAOYSA-N
Molecular Weight 362.938 g/mol
SMILES C(CC(OCCCCCCCCCCCl)=O)C(OCCCCC)=O