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4-Thia-1-azabicyclo[3.2.0]heptan-7-one, 6,6-dibromo-2-(fluoromethyl)-3,3-dimethyl-, (2S-cis)-
SpectraBase Compound ID fF8vTM8NJU
InChI InChI=1S/C8H10Br2FNOS/c1-7(2)4(3-11)12-5(13)8(9,10)6(12)14-7/h4,6H,3H2,1-2H3/t4-,6+/m0/s1
InChIKey XKZNCWGKEOSHTN-UJURSFKZSA-N
Mol Weight 347.04 g/mol
Molecular Formula C8H10Br2FNOS
Exact Mass 344.883389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2J7yvNOgWuW
Name 4-Thia-1-azabicyclo[3.2.0]heptan-7-one, 6,6-dibromo-2-(fluoromethyl)-3,3-dimethyl-, (2S-cis)-
CAS Registry Number 116114-73-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10Br2FNOS
InChI InChI=1S/C8H10Br2FNOS/c1-7(2)4(3-11)12-5(13)8(9,10)6(12)14-7/h4,6H,3H2,1-2H3/t4-,6+/m0/s1
InChIKey XKZNCWGKEOSHTN-UJURSFKZSA-N
Molecular Weight 347.040 g/mol
SMILES [C@@]12(N([C@](C(S2)(C)C)(CF)[H])C(C1(Br)Br)=O)[H]
SPLASH splash10-00xr-7393000000-bf9b0e80f619ec5912b4
Source of Spectrum KC-1988-1553-8
Synonyms (2S,5R)-6,6-dibromo-2-(fluoromethyl)-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptan-7-one 6,6-Dibromo-3.alpha.-fluoromethyl-2,2-dimethylpenam
Wiley ID 1338451