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Glutaric acid, 2-(3-chlorophenyl)ethyl pentadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-(3-chlorophenyl)ethyl pentadecyl ester
SpectraBase Compound ID FlIN5dPucfB
InChI InChI=1S/C28H45ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22-32-27(30)19-16-20-28(31)33-23-21-25-17-15-18-26(29)24-25/h15,17-18,24H,2-14,16,19-23H2,1H3
InChIKey IQJZTDIXZYGJRV-UHFFFAOYSA-N
Mol Weight 481.1 g/mol
Molecular Formula C28H45ClO4
Exact Mass 480.300638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KHNtKnJsdw
Name Glutaric acid, 2-(3-chlorophenyl)ethyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 480.300637625 u
Formula C28H45ClO4
InChI InChI=1S/C28H45ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22-32-27(30)19-16-20-28(31)33-23-21-25-17-15-18-26(29)24-25/h15,17-18,24H,2-14,16,19-23H2,1H3
InChIKey IQJZTDIXZYGJRV-UHFFFAOYSA-N
Molecular Weight 481.117 g/mol
SMILES C(OCCC1=CC(=CC=C1)Cl)(=O)CCCC(OCCCCCCCCCCCCCCC)=O