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Carbonic acid, 4-[[[4-[(propoxycarbonyl)oxy]phenyl]imino]methyl]phenyl propyl ester
SpectraBase Compound ID KZ9Zv3iGN4q
InChI InChI=1S/C21H23NO6/c1-3-13-25-20(23)27-18-9-5-16(6-10-18)15-22-17-7-11-19(12-8-17)28-21(24)26-14-4-2/h5-12,15H,3-4,13-14H2,1-2H3/b22-15+
InChIKey PGIPFCLIZDHGCO-PXLXIMEGSA-N
Mol Weight 385.42 g/mol
Molecular Formula C21H23NO6
Exact Mass 385.152537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10AEckUjLG0
Name Carbonic acid, 4-[[[4-[(propoxycarbonyl)oxy]phenyl]imino]methyl]phenyl propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 385.152537459 u
Formula C21H23NO6
InChI InChI=1S/C21H23NO6/c1-3-13-25-20(23)27-18-9-5-16(6-10-18)15-22-17-7-11-19(12-8-17)28-21(24)26-14-4-2/h5-12,15H,3-4,13-14H2,1-2H3/b22-15+
InChIKey PGIPFCLIZDHGCO-PXLXIMEGSA-N
Molecular Weight 385.416 g/mol
SMILES CCCOC(=O)OC1=CC=C(C=C1)\C=N\C1=CC=C(C=C1)OC(=O)OCCC