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(1.alpha.,2.alpha.,5.alpha.)-(+-)-2-(2-Propenyl)-4-thioxo-3-azabicyclo[3.1.0]hexene-3-propanoic acid methyl ester
SpectraBase Compound ID 7Xd9KW30fRB
InChI InChI=1S/C12H17NO2S/c1-3-4-10-8-7-9(8)12(16)13(10)6-5-11(14)15-2/h3,8-10H,1,4-7H2,2H3/t8-,9+,10+/m1/s1
InChIKey WRXUAHDUYQJCKO-UTLUCORTSA-N
Mol Weight 239.33 g/mol
Molecular Formula C12H17NO2S
Exact Mass 239.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LqUSt2Ed5C
Name (1.alpha.,2.alpha.,5.alpha.)-(+-)-2-(2-Propenyl)-4-thioxo-3-azabicyclo[3.1.0]hexene-3-propanoic acid methyl ester
Alternate Name(s) (1.alpha.,2.alpha.,5.alpha.)-(+-)-2-(2-Propenyl)-4-thioxo-3-azabicyclo[3.1.0]hexane-3-propanoic acid methyl ester
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Formula C12H17NO2S
InChI InChI=1S/C12H17NO2S/c1-3-4-10-8-7-9(8)12(16)13(10)6-5-11(14)15-2/h3,8-10H,1,4-7H2,2H3/t8-,9+,10+/m1/s1
InChIKey WRXUAHDUYQJCKO-UTLUCORTSA-N
Molecular Weight 239.333 g/mol
SMILES [C@]12([C@]([C@@](CC=C)([H])N(C2=S)CCC(=O)OC)(C1)[H])[H]
SPLASH splash10-03dr-0980000000-98cab08c8ae4c374ce87
Source of Spectrum C-115-36-35
Wiley ID 1241815