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[3-(Methoxycarbonylmethyl-carbamoyl)-benzoylamino]-acetic acid, methyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

[3-(Methoxycarbonylmethyl-carbamoyl)-benzoylamino]-acetic acid, methyl ester
SpectraBase Compound ID 5L9GP1P3EW1
InChI InChI=1S/C14H16N2O6/c1-21-11(17)7-15-13(19)9-4-3-5-10(6-9)14(20)16-8-12(18)22-2/h3-6H,7-8H2,1-2H3,(H,15,19)(H,16,20)
InChIKey LVLDXANXESUGTA-UHFFFAOYSA-N
Mol Weight 308.29 g/mol
Molecular Formula C14H16N2O6
Exact Mass 308.100836 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5We2hoTVjL0
Name [3-(Methoxycarbonylmethyl-carbamoyl)-benzoylamino]-acetic acid, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 308.100836237 u
Formula C14H16N2O6
InChI InChI=1S/C14H16N2O6/c1-21-11(17)7-15-13(19)9-4-3-5-10(6-9)14(20)16-8-12(18)22-2/h3-6H,7-8H2,1-2H3,(H,15,19)(H,16,20)
InChIKey LVLDXANXESUGTA-UHFFFAOYSA-N
Molecular Weight 308.290 g/mol
SMILES C(C1=CC(C(NCC(=O)OC)=O)=CC=C1)(NCC(=O)OC)=O