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1'-Benzoylbutyl methanesulfonate
SpectraBase Compound ID 6LmVgYWEIhG
InChI InChI=1S/C12H16O4S/c1-3-7-11(16-17(2,14)15)12(13)10-8-5-4-6-9-10/h4-6,8-9,11H,3,7H2,1-2H3
InChIKey NLOVRUYHCRJWEB-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C12H16O4S
Exact Mass 256.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Pm8EVBM5wv
Name 1'-Benzoylbutyl methanesulfonate
Alternate Name(s) 1-Benzoylbutyl methanesulfonate
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Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c1-3-7-11(16-17(2,14)15)12(13)10-8-5-4-6-9-10/h4-6,8-9,11H,3,7H2,1-2H3
InChIKey NLOVRUYHCRJWEB-UHFFFAOYSA-N
Molecular Weight 256.316 g/mol
SMILES CS(=O)(=O)OC(CCC)C(c1ccccc1)=O
SPLASH splash10-0a4i-3900000000-9526b1bc0f6e4fa114da
Source of Spectrum H-86-883-3
Wiley ID 1525370