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2-(1-Phenylsulfonyl-1-methylethyl)-3-methyloxtane
SpectraBase Compound ID J468bcCzNLJ
InChI InChI=1S/C13H18O3S/c1-10-9-16-12(10)13(2,3)17(14,15)11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3/t10-,12-/m0/s1
InChIKey NSBHXDBDEQJITA-JQWIXIFHSA-N
Mol Weight 254.34 g/mol
Molecular Formula C13H18O3S
Exact Mass 254.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2y8Gt6jUYm6
Name 2-(1-Phenylsulfonyl-1-methylethyl)-3-methyloxtane
Alternate Name(s) (2S,3S)-2-[2-(benzenesulfonyl)propan-2-yl]-3-methyloxetane (2S,3S)-2-[1-(benzenesulfonyl)-1-methyl-ethyl]-3-methyl-oxetane (2S,3S)-3-methyl-2-[2-(phenylsulfonyl)propan-2-yl]oxetane
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Formula C13H18O3S
InChI InChI=1S/C13H18O3S/c1-10-9-16-12(10)13(2,3)17(14,15)11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3/t10-,12-/m0/s1
InChIKey NSBHXDBDEQJITA-JQWIXIFHSA-N
Molecular Weight 254.344 g/mol
SMILES C(S(=O)(=O)c1ccccc1)([C@]1(OC[C@@]1(C)[H])[H])(C)C
SPLASH splash10-03di-1900000000-7f2a969a76a35a3dbbd1
Source of Spectrum K-2001-2995-75
Wiley ID 1580047