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methyl (2R)-1-[(4-fluorophenyl)methyl]-4-oxo-azetidine-2-carboxylate
SpectraBase Compound ID CIzmPsDD9ad
InChI InChI=1S/C12H12FNO3/c1-17-12(16)10-6-11(15)14(10)7-8-2-4-9(13)5-3-8/h2-5,10H,6-7H2,1H3/t10-/m1/s1
InChIKey YWIJEGDFNXTJDK-SNVBAGLBSA-N
Mol Weight 237.23 g/mol
Molecular Formula C12H12FNO3
Exact Mass 237.080121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WXUZwzprbu
Name methyl (2R)-1-[(4-fluorophenyl)methyl]-4-oxo-azetidine-2-carboxylate
Appearance Oil
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Formula C12H12FNO3
InChI InChI=1S/C12H12FNO3/c1-17-12(16)10-6-11(15)14(10)7-8-2-4-9(13)5-3-8/h2-5,10H,6-7H2,1H3/t10-/m1/s1
InChIKey YWIJEGDFNXTJDK-SNVBAGLBSA-N
Ionization Type EI
Molecular Weight 237.230 g/mol
Optical Rotation [a]D25 = +28 (c = 0.5, CHCl3)
Reported Formula C12H12NO3F
SMILES C1C(N([C@]1(C(OC)=O)[H])Cc1ccc(cc1)F)=O
SPLASH splash10-0a4i-0910000000-d18ae11178190fad13a3
Sample Comments >99.5% ee
Source of Spectrum CN102126999B
Wiley ID 1846490