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Glutaric acid, 3-nitrophenyl tridecyl ester
SpectraBase Compound ID 3IbnLzQXvyL
InChI InChI=1S/C24H37NO6/c1-2-3-4-5-6-7-8-9-10-11-12-19-30-23(26)17-14-18-24(27)31-22-16-13-15-21(20-22)25(28)29/h13,15-16,20H,2-12,14,17-19H2,1H3
InChIKey CEVGLMDFNZKKNP-UHFFFAOYSA-N
Mol Weight 435.6 g/mol
Molecular Formula C24H37NO6
Exact Mass 435.262088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6CngF494Zog
Name Glutaric acid, 3-nitrophenyl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 435.262087909 u
Formula C24H37NO6
InChI InChI=1S/C24H37NO6/c1-2-3-4-5-6-7-8-9-10-11-12-19-30-23(26)17-14-18-24(27)31-22-16-13-15-21(20-22)25(28)29/h13,15-16,20H,2-12,14,17-19H2,1H3
InChIKey CEVGLMDFNZKKNP-UHFFFAOYSA-N
Molecular Weight 435.561 g/mol
SMILES CCCCCCCCCCCCCOC(CCCC(OC1=CC=CC(=C1)N(=O)=O)=O)=O