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(S)-tert-butyl 5-chloro-2-fluoro-1-oxo-2,3-dihydro-1H-indene-2-carboxylate
SpectraBase Compound ID CG7o3X8V60m
InChI InChI=1S/C14H14ClFO3/c1-13(2,3)19-12(18)14(16)7-8-6-9(15)4-5-10(8)11(14)17/h4-6H,7H2,1-3H3/t14-/m0/s1
InChIKey GJEPETJHYJXGNL-AWEZNQCLSA-N
Mol Weight 284.71 g/mol
Molecular Formula C14H14ClFO3
Exact Mass 284.06155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeNY6vjBJIh
Name (S)-tert-butyl 5-chloro-2-fluoro-1-oxo-2,3-dihydro-1H-indene-2-carboxylate
Alternate Name(s) (2S)-6-chloro-2-fluoro-3-oxo-1H-indene-2-carboxylic acid tert-butyl ester tert-Butyl (2S)-6-chloro-2-fluoro-3-oxo-1H-indene-2-carboxylate tert-Butyl (2S)-5-chloro-2-fluoro-1-oxo-indane-2-carboxylate tert-Butyl (2S)-6-chloranyl-2-fluoranyl-3-oxidanylidene-1H-indene-2-carboxylate
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Formula C14H14ClFO3
InChI InChI=1S/C14H14ClFO3/c1-13(2,3)19-12(18)14(16)7-8-6-9(15)4-5-10(8)11(14)17/h4-6H,7H2,1-3H3/t14-/m0/s1
InChIKey GJEPETJHYJXGNL-AWEZNQCLSA-N
Literature Reference DOI 10.1039/c4cc01631a
Molecular Weight 284.714 g/mol
SMILES c1cc(cc2c1C(=O)[C@](C(OC(C)(C)C)=O)(C2)F)Cl
SPLASH splash10-0a59-6910000000-342fa208fa7bc462a2db
Source of Spectrum KD-50-7870/SMS21-5e
Wiley ID 1754621