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(2R)-2-hydroxy-2-[(methylsulfonimidoyl)methyl]butanedioic acid
SpectraBase Compound ID IzInpjRZR8s
InChI InChI=1S/C6H11NO6S/c1-14(7,13)3-6(12,5(10)11)2-4(8)9/h7,12H,2-3H2,1H3,(H,8,9)(H,10,11)/t6-,14?/m0/s1
InChIKey MIJOCOSWJQYXGU-TZKMECQKSA-N
Mol Weight 225.22 g/mol
Molecular Formula C6H11NO6S
Exact Mass 225.030708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZcMGjPbV2i
Name (2R)-2-hydroxy-2-[(methylsulfonimidoyl)methyl]butanedioic acid
Alternate Name(s) (2R)-2-hydroxy-2-[(methylsulfonimidoyl)methyl]succinic acid (2R)-2-[(methylsulfonimidoyl)methyl]-2-oxidanyl-butanedioic acid
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Formula C6H11NO6S
InChI InChI=1S/C6H11NO6S/c1-14(7,13)3-6(12,5(10)11)2-4(8)9/h7,12H,2-3H2,1H3,(H,8,9)(H,10,11)/t6-,14?/m0/s1
InChIKey MIJOCOSWJQYXGU-TZKMECQKSA-N
Molecular Weight 225.215 g/mol
SMILES N=S(C[C@@](CC(=O)O)(C(=O)O)O)(=O)C
SPLASH splash10-000f-9610000000-ccf758c2943e80a59e9a
Source of Spectrum E1-35-4882-12
Wiley ID 1574544