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Glutaric acid, 2-bromobenzyl dodecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-bromobenzyl dodecyl ester
SpectraBase Compound ID 7Fu4ugm7QLn
InChI InChI=1S/C24H37BrO4/c1-2-3-4-5-6-7-8-9-10-13-19-28-23(26)17-14-18-24(27)29-20-21-15-11-12-16-22(21)25/h11-12,15-16H,2-10,13-14,17-20H2,1H3
InChIKey KASYHDMJGHWBOJ-UHFFFAOYSA-N
Mol Weight 469.5 g/mol
Molecular Formula C24H37BrO4
Exact Mass 468.187523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KN36foBZFyK
Name Glutaric acid, 2-bromobenzyl dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 468.187522667 u
Formula C24H37BrO4
InChI InChI=1S/C24H37BrO4/c1-2-3-4-5-6-7-8-9-10-13-19-28-23(26)17-14-18-24(27)29-20-21-15-11-12-16-22(21)25/h11-12,15-16H,2-10,13-14,17-20H2,1H3
InChIKey KASYHDMJGHWBOJ-UHFFFAOYSA-N
Molecular Weight 469.460 g/mol
SMILES C(OCC1=C(C=CC=C1)Br)(=O)CCCC(OCCCCCCCCCCCC)=O