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Oxalic acid, monoamide, N-(2-fluorophenyl)-, isohexyl ester
SpectraBase Compound ID Hq3TUPPD3B5
InChI InChI=1S/C14H18FNO3/c1-10(2)6-5-9-19-14(18)13(17)16-12-8-4-3-7-11(12)15/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,17)
InChIKey YMVCNKZRCXUYMX-UHFFFAOYSA-N
Mol Weight 267.3 g/mol
Molecular Formula C14H18FNO3
Exact Mass 267.127072 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FeRMBzewuhN
Name Oxalic acid, monoamide, N-(2-fluorophenyl)-, isohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 267.127071604 u
Formula C14H18FNO3
InChI InChI=1S/C14H18FNO3/c1-10(2)6-5-9-19-14(18)13(17)16-12-8-4-3-7-11(12)15/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,17)
InChIKey YMVCNKZRCXUYMX-UHFFFAOYSA-N
Molecular Weight 267.300 g/mol
SMILES C(C(=O)NC1=C(C=CC=C1)F)(OCCCC(C)C)=O