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Phthalic acid, 3-chlorophenyl decyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 3-chlorophenyl decyl ester
SpectraBase Compound ID 2yaYPSbpKI5
InChI InChI=1S/C24H29ClO4/c1-2-3-4-5-6-7-8-11-17-28-23(26)21-15-9-10-16-22(21)24(27)29-20-14-12-13-19(25)18-20/h9-10,12-16,18H,2-8,11,17H2,1H3
InChIKey NIKYIVSCFJZVFK-UHFFFAOYSA-N
Mol Weight 416.95 g/mol
Molecular Formula C24H29ClO4
Exact Mass 416.175437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBlOIvhmaWs
Name Phthalic acid, 3-chlorophenyl decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 416.175437110 u
Formula C24H29ClO4
InChI InChI=1S/C24H29ClO4/c1-2-3-4-5-6-7-8-11-17-28-23(26)21-15-9-10-16-22(21)24(27)29-20-14-12-13-19(25)18-20/h9-10,12-16,18H,2-8,11,17H2,1H3
InChIKey NIKYIVSCFJZVFK-UHFFFAOYSA-N
Molecular Weight 416.945 g/mol
SMILES C1=C(C=CC=C1Cl)OC(C1=C(C=CC=C1)C(=O)OCCCCCCCCCC)=O