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Methyl 6-.alpha.-Chloro-2.beta.-(chloromethyl)-2.alpha.-methylpenam-3.alpha.-carboxylate
SpectraBase Compound ID DJPJhjkkqxZ
InChI InChI=1S/C9H11Cl2NO3S/c1-9(3-10)5(8(14)15-2)12-6(13)4(11)7(12)16-9/h4-5,7H,3H2,1-2H3/t4-,5-,7+,9-/m0/s1
InChIKey UBCADTYNDIZILV-PGLSMWOHSA-N
Mol Weight 284.16 g/mol
Molecular Formula C9H11Cl2NO3S
Exact Mass 282.98367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fHOoVK4taK
Name Methyl 6-.alpha.-Chloro-2.beta.-(chloromethyl)-2.alpha.-methylpenam-3.alpha.-carboxylate
Alternate Name(s) Methyl (2S,3R,5R,6S)-6-chloro-3-(chloromethyl)-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
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Formula C9H11Cl2NO3S
InChI InChI=1S/C9H11Cl2NO3S/c1-9(3-10)5(8(14)15-2)12-6(13)4(11)7(12)16-9/h4-5,7H,3H2,1-2H3/t4-,5-,7+,9-/m0/s1
InChIKey UBCADTYNDIZILV-PGLSMWOHSA-N
Molecular Weight 284.157 g/mol
SMILES [C@@]12(N([C@]([C@@](S2)(CCl)C)(C(=O)OC)[H])C([C@@]1(Cl)[H])=O)[H]
SPLASH splash10-0a4i-2390000000-dc3113577e845995ffc2
Source of Spectrum F4-0-3401-31
Wiley ID 1620800