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Dimethyl 5-{[(2-methylphenoxy)acetyl]amino}isophthalate

View entire compound with spectra: 2 NMR

Dimethyl 5-{[(2-methylphenoxy)acetyl]amino}isophthalate
SpectraBase Compound ID 2Cra3Xhoint
InChI InChI=1S/C19H19NO6/c1-12-6-4-5-7-16(12)26-11-17(21)20-15-9-13(18(22)24-2)8-14(10-15)19(23)25-3/h4-10H,11H2,1-3H3,(H,20,21)
InChIKey YSAUFVAZCGXSGN-UHFFFAOYSA-N
Mol Weight 357.36 g/mol
Molecular Formula C19H19NO6
Exact Mass 357.121237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JFIggGbMCB3
Name Dimethyl 5-{[(2-methylphenoxy)acetyl]amino}isophthalate
Comments Computed using HOSE algorithm
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Exact Mass 357.121237330 u
Formula C19H19NO6
InChI InChI=1S/C19H19NO6/c1-12-6-4-5-7-16(12)26-11-17(21)20-15-9-13(18(22)24-2)8-14(10-15)19(23)25-3/h4-10H,11H2,1-3H3,(H,20,21)
InChIKey YSAUFVAZCGXSGN-UHFFFAOYSA-N
Molecular Weight 357.362 g/mol
SMILES N(C(=O)COC=1C(C)=CC=CC1)C=1C=C(C(=O)OC)C=C(C(=O)OC)C1