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Dimethyl [(1R)-1-{[(R)-(tert-Butyl)sulfinyl]amino}-3-methylbutyl]propanedioate
SpectraBase Compound ID 4w3Dz5QquFq
InChI InChI=1S/C14H27NO5S/c1-9(2)8-10(15-21(18)14(3,4)5)11(12(16)19-6)13(17)20-7/h9-11,15H,8H2,1-7H3/t10-,21?/m1/s1
InChIKey CQBFCLODJYGQJS-KXPFFURISA-N
Mol Weight 321.43 g/mol
Molecular Formula C14H27NO5S
Exact Mass 321.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaoeTxwkQTS
Name Dimethyl [(1R)-1-{[(R)-(tert-Butyl)sulfinyl]amino}-3-methylbutyl]propanedioate
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Formula C14H27NO5S
InChI InChI=1S/C14H27NO5S/c1-9(2)8-10(15-21(18)14(3,4)5)11(12(16)19-6)13(17)20-7/h9-11,15H,8H2,1-7H3/t10-,21?/m1/s1
InChIKey CQBFCLODJYGQJS-KXPFFURISA-N
Literature Reference DOI 10.1002/hlca.201200303
Molecular Weight 321.432 g/mol
SMILES N([C@](CC(C)C)(C(C(=O)OC)C(=O)OC)[H])[S@@](C(C)(C)C)=O
SPLASH splash10-001i-3900000000-d8b120701f3c484d875c
Source of Spectrum H-95-1797-3f
Synonyms Dimethyl 2-((R)-1-(((R)-tert-butylsulfinyl)amino)-3-methylbutyl)malonate
Wiley ID 1784173