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1-([4-(Butane-1-sulfonyl)butane]sulfonyl)butane
SpectraBase Compound ID Aop2GMaLjle
InChI InChI=1S/C12H26O4S2/c1-3-5-9-17(13,14)11-7-8-12-18(15,16)10-6-4-2/h3-12H2,1-2H3
InChIKey AQMIWZHQRPXARZ-UHFFFAOYSA-N
Mol Weight 298.46 g/mol
Molecular Formula C12H26O4S2
Exact Mass 298.127252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWymkdDIWVn
Name 1-([4-(Butane-1-sulfonyl)butane]sulfonyl)butane
Comments Computed using HOSE algorithm
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Exact Mass 298.127251661 u
Formula C12H26O4S2
InChI InChI=1S/C12H26O4S2/c1-3-5-9-17(13,14)11-7-8-12-18(15,16)10-6-4-2/h3-12H2,1-2H3
InChIKey AQMIWZHQRPXARZ-UHFFFAOYSA-N
SMILES CCCCS(CCCCS(CCCC)(=O)=O)(=O)=O