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2,3,3,3-Tetrafluoro-2-(5-oxo-4-oxa-tricyclo[4.2.1.0(3,7)]non-2-ylsulfanyl)-propionic acid methyl ester
SpectraBase Compound ID EO4Dhq5GTIX
InChI InChI=1S/C12H12F4O4S/c1-19-10(18)11(13,12(14,15)16)21-8-4-2-5-6(3-4)9(17)20-7(5)8/h4-8H,2-3H2,1H3/t4-,5+,6-,7-,8-,11?/m0/s1
InChIKey LYSQQXFQRWTWQE-UHFFFAOYSA-N
Mol Weight 328.28 g/mol
Molecular Formula C12H12F4O4S
Exact Mass 328.039243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29kfIk0aAa
Name 2,3,3,3-Tetrafluoro-2-(5-oxo-4-oxa-tricyclo[4.2.1.0(3,7)]non-2-ylsulfanyl)-propionic acid methyl ester
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Formula C12H12F4O4S
InChI InChI=1S/C12H12F4O4S/c1-19-10(18)11(13,12(14,15)16)21-8-4-2-5-6(3-4)9(17)20-7(5)8/h4-8H,2-3H2,1H3/t4-,5+,6-,7-,8-,11?/m0/s1
InChIKey LYSQQXFQRWTWQE-UHFFFAOYSA-N
Molecular Weight 328.278 g/mol
SMILES [C@@]12([C@]([C@]3(C[C@@]2([C@](C3)(C(O1)=O)[H])[H])[H])(SC(C(OC)=O)(F)C(F)(F)F)[H])[H]
SPLASH splash10-00ou-9300000000-0ecb69781367ecb3f145
Wiley ID 1464375