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L-Serine, N,o-bis(3-fluorobenzoyl)-, methyl ester

View entire compound with spectra: 1 NMR

L-Serine, N,o-bis(3-fluorobenzoyl)-, methyl ester
SpectraBase Compound ID IEn6WA9hpSr
InChI InChI=1S/C18H15F2NO5/c1-25-18(24)15(21-16(22)11-4-2-6-13(19)8-11)10-26-17(23)12-5-3-7-14(20)9-12/h2-9,15H,10H2,1H3,(H,21,22)
InChIKey PTXSJEPNTGOUHE-UHFFFAOYSA-N
Mol Weight 363.32 g/mol
Molecular Formula C18H15F2NO5
Exact Mass 363.091829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ycI7zn6VPm
Name L-Serine, N,o-bis(3-fluorobenzoyl)-, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 363.091828908 u
Formula C18H15F2NO5
InChI InChI=1S/C18H15F2NO5/c1-25-18(24)15(21-16(22)11-4-2-6-13(19)8-11)10-26-17(23)12-5-3-7-14(20)9-12/h2-9,15H,10H2,1H3,(H,21,22)
InChIKey PTXSJEPNTGOUHE-UHFFFAOYSA-N
Molecular Weight 363.317 g/mol
SMILES C1=C(C=C(C=C1)C(OCC(C(OC)=O)NC(C1=CC(=CC=C1)F)=O)=O)F