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Succinic acid, 3-chlorobenzyl dodecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3-chlorobenzyl dodecyl ester
SpectraBase Compound ID ECoB0noU4IC
InChI InChI=1S/C23H35ClO4/c1-2-3-4-5-6-7-8-9-10-11-17-27-22(25)15-16-23(26)28-19-20-13-12-14-21(24)18-20/h12-14,18H,2-11,15-17,19H2,1H3
InChIKey HRIPEZHRLCKAIA-UHFFFAOYSA-N
Mol Weight 411.0 g/mol
Molecular Formula C23H35ClO4
Exact Mass 410.222387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CF3irEythTo
Name Succinic acid, 3-chlorobenzyl dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 410.222387303 u
Formula C23H35ClO4
InChI InChI=1S/C23H35ClO4/c1-2-3-4-5-6-7-8-9-10-11-17-27-22(25)15-16-23(26)28-19-20-13-12-14-21(24)18-20/h12-14,18H,2-11,15-17,19H2,1H3
InChIKey HRIPEZHRLCKAIA-UHFFFAOYSA-N
Molecular Weight 410.982 g/mol
SMILES C(CCC(OCC1=CC(=CC=C1)Cl)=O)(OCCCCCCCCCCCC)=O