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Methyl 6-.alpha.-Bromo-2.beta.-(chloromethyl)-2.alpha.-methylpenam-3.alpha.-carboxylate
SpectraBase Compound ID 3aiV97IGbqt
InChI InChI=1S/C9H11BrClNO3S/c1-9(3-11)5(8(14)15-2)12-6(13)4(10)7(12)16-9/h4-5,7H,3H2,1-2H3/t4-,5-,7+,9-/m0/s1
InChIKey FDTDXIORZYVLHT-PGLSMWOHSA-N
Mol Weight 328.61 g/mol
Molecular Formula C9H11BrClNO3S
Exact Mass 326.933155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoSX0eEzET0
Name Methyl 6-.alpha.-Bromo-2.beta.-(chloromethyl)-2.alpha.-methylpenam-3.alpha.-carboxylate
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Formula C9H11BrClNO3S
InChI InChI=1S/C9H11BrClNO3S/c1-9(3-11)5(8(14)15-2)12-6(13)4(10)7(12)16-9/h4-5,7H,3H2,1-2H3/t4-,5-,7+,9-/m0/s1
InChIKey FDTDXIORZYVLHT-PGLSMWOHSA-N
Molecular Weight 328.608 g/mol
SMILES [C@@]12(N([C@]([C@@](S2)(CCl)C)(C(=O)OC)[H])C([C@@]1(Br)[H])=O)[H]
SPLASH splash10-0cdi-2192000000-a373518aa9a332ef6107
Source of Spectrum F4-0-3402-36
Synonyms Methyl (2S,3R,5R,6S)-6-bromo-3-(chloromethyl)-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Wiley ID 1620799