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Glutaric acid, 5-bromo-2-methoxybenzyl decyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 5-bromo-2-methoxybenzyl decyl ester
SpectraBase Compound ID 94RVO5dJeQP
InChI InChI=1S/C23H35BrO5/c1-3-4-5-6-7-8-9-10-16-28-22(25)12-11-13-23(26)29-18-19-17-20(24)14-15-21(19)27-2/h14-15,17H,3-13,16,18H2,1-2H3
InChIKey HSDXTUGIVIVWIT-UHFFFAOYSA-N
Mol Weight 471.4 g/mol
Molecular Formula C23H35BrO5
Exact Mass 470.166787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EFkxyywo9u8
Name Glutaric acid, 5-bromo-2-methoxybenzyl decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 470.166787222 u
Formula C23H35BrO5
InChI InChI=1S/C23H35BrO5/c1-3-4-5-6-7-8-9-10-16-28-22(25)12-11-13-23(26)29-18-19-17-20(24)14-15-21(19)27-2/h14-15,17H,3-13,16,18H2,1-2H3
InChIKey HSDXTUGIVIVWIT-UHFFFAOYSA-N
Molecular Weight 471.432 g/mol
SMILES C(OCC=1C=C(C=CC1OC)Br)(=O)CCCC(OCCCCCCCCCC)=O