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Glutaric acid, 3-nitrophenethyl undecyl ester
SpectraBase Compound ID H7mLFDFEJz5
InChI InChI=1S/C24H37NO6/c1-2-3-4-5-6-7-8-9-10-18-30-23(26)15-12-16-24(27)31-19-17-21-13-11-14-22(20-21)25(28)29/h11,13-14,20H,2-10,12,15-19H2,1H3
InChIKey NUUNDBWLJVNUOA-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 6Jx2EMwsF1s
Name Glutaric acid, 3-nitrophenethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 435.262087909 u
Formula C24H37NO6
InChI InChI=1S/C24H37NO6/c1-2-3-4-5-6-7-8-9-10-18-30-23(26)15-12-16-24(27)31-19-17-21-13-11-14-22(20-21)25(28)29/h11,13-14,20H,2-10,12,15-19H2,1H3
InChIKey NUUNDBWLJVNUOA-UHFFFAOYSA-N
Molecular Weight 435.561 g/mol
SMILES C(OCCC1=CC=CC(=C1)N(=O)=O)(=O)CCCC(OCCCCCCCCCCC)=O