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Succinic acid, 2-chloro-6-fluorobenzyl tridecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 2-chloro-6-fluorobenzyl tridecyl ester
SpectraBase Compound ID 9HxiAShE9vr
InChI InChI=1S/C24H36ClFO4/c1-2-3-4-5-6-7-8-9-10-11-12-18-29-23(27)16-17-24(28)30-19-20-21(25)14-13-15-22(20)26/h13-15H,2-12,16-19H2,1H3
InChIKey VMZMLDFPHJUDMD-UHFFFAOYSA-N
Mol Weight 443.0 g/mol
Molecular Formula C24H36ClFO4
Exact Mass 442.228615 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7stnsYMPQG3
Name Succinic acid, 2-chloro-6-fluorobenzyl tridecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.228615498 u
Formula C24H36ClFO4
InChI InChI=1S/C24H36ClFO4/c1-2-3-4-5-6-7-8-9-10-11-12-18-29-23(27)16-17-24(28)30-19-20-21(25)14-13-15-22(20)26/h13-15H,2-12,16-19H2,1H3
InChIKey VMZMLDFPHJUDMD-UHFFFAOYSA-N
Molecular Weight 442.999 g/mol
SMILES C1=CC(=C(C(=C1)Cl)COC(=O)CCC(OCCCCCCCCCCCCC)=O)F