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2-[(4-Fluorophenyl)amino]-2-oxoethyl formate
SpectraBase Compound ID IZ3ZjBz07pA
InChI InChI=1S/C9H8FNO3/c10-7-1-3-8(4-2-7)11-9(13)5-14-6-12/h1-4,6H,5H2,(H,11,13)
InChIKey UQUUTWONDJFRJH-UHFFFAOYSA-N
Mol Weight 197.17 g/mol
Molecular Formula C9H8FNO3
Exact Mass 197.048821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9pHbjAaFdU8
Name 2-[(4-Fluorophenyl)amino]-2-oxoethyl formate
Comments Computed using HOSE algorithm
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Exact Mass 197.048821282 u
Formula C9H8FNO3
InChI InChI=1S/C9H8FNO3/c10-7-1-3-8(4-2-7)11-9(13)5-14-6-12/h1-4,6H,5H2,(H,11,13)
InChIKey UQUUTWONDJFRJH-UHFFFAOYSA-N
Molecular Weight 197.165 g/mol
SMILES C=1C(NC(=O)COC=O)=CC=C(C1)F