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(1R*,6R*)-1-Chloro-6-methyl-7-(4-chlorophenyl)-5-oxa-2-thia-7-azabicyclo[4.2.0]octan-8-one
SpectraBase Compound ID 6MnndAWT6nk
InChI InChI=1S/C12H11Cl2NO2S/c1-11-12(14,18-7-6-17-11)10(16)15(11)9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3/t11-,12-/m1/s1
InChIKey YAUGUZWQCGCQEH-VXGBXAGGSA-N
Mol Weight 304.19 g/mol
Molecular Formula C12H11Cl2NO2S
Exact Mass 302.988755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6jAeF8qPzm
Name (1R*,6R*)-1-Chloro-6-methyl-7-(4-chlorophenyl)-5-oxa-2-thia-7-azabicyclo[4.2.0]octan-8-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H11Cl2NO2S
InChI InChI=1S/C12H11Cl2NO2S/c1-11-12(14,18-7-6-17-11)10(16)15(11)9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3/t11-,12-/m1/s1
InChIKey YAUGUZWQCGCQEH-VXGBXAGGSA-N
Molecular Weight 304.191 g/mol
SMILES [C@@]12([C@](OCCS2)(C)N(C1=O)c1ccc(cc1)Cl)Cl
SPLASH splash10-0zfr-0009000000-957cd866ec3079456df7
Source of Spectrum H1-50-717-0
Synonyms (1R,6R)-1-chloro-7-(4-chlorophenyl)-6-methyl-5-oxa-2-thia-7-azabicyclo[4.2.0]octan-8-one
Wiley ID 816908