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Glutaric acid, 2-nitrobenzyl undecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-nitrobenzyl undecyl ester
SpectraBase Compound ID KQEez1kpVHi
InChI InChI=1S/C23H35NO6/c1-2-3-4-5-6-7-8-9-12-18-29-22(25)16-13-17-23(26)30-19-20-14-10-11-15-21(20)24(27)28/h10-11,14-15H,2-9,12-13,16-19H2,1H3
InChIKey AQHIJUACGNGFOA-UHFFFAOYSA-N
Mol Weight 421.5 g/mol
Molecular Formula C23H35NO6
Exact Mass 421.246438 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EhjdbN6lOMk
Name Glutaric acid, 2-nitrobenzyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 421.246437845 u
Formula C23H35NO6
InChI InChI=1S/C23H35NO6/c1-2-3-4-5-6-7-8-9-12-18-29-22(25)16-13-17-23(26)30-19-20-14-10-11-15-21(20)24(27)28/h10-11,14-15H,2-9,12-13,16-19H2,1H3
InChIKey AQHIJUACGNGFOA-UHFFFAOYSA-N
Molecular Weight 421.534 g/mol
SMILES C(OCC=1C=CC=CC1N(=O)=O)(=O)CCCC(OCCCCCCCCCCC)=O