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3-(N-Boc-amino)-1-(methylsulfonyl)-1-propene
SpectraBase Compound ID 87qfL6IBF1w
InChI InChI=1S/C9H17NO4S/c1-9(2,3)14-8(11)10-6-5-7-15(4,12)13/h5,7H,6H2,1-4H3,(H,10,11)/b7-5+
InChIKey DFXMOFQFGNFDGT-FNORWQNLSA-N
Mol Weight 235.3 g/mol
Molecular Formula C9H17NO4S
Exact Mass 235.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUNZjgPqEYT
Name 3-(N-Boc-amino)-1-(methylsulfonyl)-1-propene
Alternate Name(s) N-[(E)-3-methylsulfonylprop-2-enyl]carbamic acid tert-butyl ester tert-Butyl N-[(E)-3-methylsulfonylallyl]carbamate tert-Butyl N-[(E)-3-methylsulfonylprop-2-enyl]carbamate
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Formula C9H17NO4S
InChI InChI=1S/C9H17NO4S/c1-9(2,3)14-8(11)10-6-5-7-15(4,12)13/h5,7H,6H2,1-4H3,(H,10,11)/b7-5+
InChIKey DFXMOFQFGNFDGT-FNORWQNLSA-N
Molecular Weight 235.298 g/mol
SMILES N(C(OC(C)(C)C)=O)C\C=C\S(=O)(=O)C
SPLASH splash10-0a4i-9500000000-b2f2d01abea0c6b57c79
Source of Spectrum F2-35-1074-12
Wiley ID 1574215