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Succinic acid, decyl 4-methoxy-3-nitrobenzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, decyl 4-methoxy-3-nitrobenzyl ester
SpectraBase Compound ID 4Em8eYPLryQ
InChI InChI=1S/C22H33NO7/c1-3-4-5-6-7-8-9-10-15-29-21(24)13-14-22(25)30-17-18-11-12-20(28-2)19(16-18)23(26)27/h11-12,16H,3-10,13-15,17H2,1-2H3
InChIKey AMJVPEKIFIEPFQ-UHFFFAOYSA-N
Mol Weight 423.5 g/mol
Molecular Formula C22H33NO7
Exact Mass 423.225702 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IDBcYJwP4S5
Name Succinic acid, decyl 4-methoxy-3-nitrobenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 423.225702400 u
Formula C22H33NO7
InChI InChI=1S/C22H33NO7/c1-3-4-5-6-7-8-9-10-15-29-21(24)13-14-22(25)30-17-18-11-12-20(28-2)19(16-18)23(26)27/h11-12,16H,3-10,13-15,17H2,1-2H3
InChIKey AMJVPEKIFIEPFQ-UHFFFAOYSA-N
Molecular Weight 423.506 g/mol
SMILES C(CCC(OCC1=CC(=C(C=C1)OC)N(=O)=O)=O)(OCCCCCCCCCC)=O