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((1R,2S)-2-Chlorosulfonyl-1-methyl-4-phenyl-butyl)-carbamic acid methyl ester
SpectraBase Compound ID FMBMPKJKoNP
InChI InChI=1S/C13H18ClNO4S/c1-10(15-13(16)19-2)12(20(14,17)18)9-8-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3,(H,15,16)/t10-,12+/m1/s1
InChIKey BILTXCAFHOPWJK-PWSUYJOCSA-N
Mol Weight 319.8 g/mol
Molecular Formula C13H18ClNO4S
Exact Mass 319.064507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENEA2puFeZa
Name ((1R,2S)-2-Chlorosulfonyl-1-methyl-4-phenyl-butyl)-carbamic acid methyl ester
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Formula C13H18ClNO4S
InChI InChI=1S/C13H18ClNO4S/c1-10(15-13(16)19-2)12(20(14,17)18)9-8-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3,(H,15,16)/t10-,12+/m1/s1
InChIKey BILTXCAFHOPWJK-PWSUYJOCSA-N
Molecular Weight 319.803 g/mol
SMILES N(C(=O)OC)[C@@]([C@@](S(=O)(=O)Cl)(CCc1ccccc1)[H])(C)[H]
SPLASH splash10-0udi-1900000000-f688406b434d2a97ef3d
Source of Spectrum C5-2002-1812-4
Synonyms (S,R)-(2-Chlorosulfonyl-1-methyl-4-phenylbutyl)carbamic acid methyl ester Methyl (1R,2S)-2-(chlorosulfonyl)-1-methyl-4-phenylbutylcarbamate
Wiley ID 1617763