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(S,R)-2-Ethoxy-1-ethynyl-1-p-toluenesulfonylcyclopropane
SpectraBase Compound ID 6GkGvLSEjZU
InChI InChI=1S/C14H16O4S/c1-4-14(17-5-2)10-13(14)18-19(15,16)12-8-6-11(3)7-9-12/h1,6-9,13H,5,10H2,2-3H3/t13-,14-/m0/s1
InChIKey IJTWQVCCNSYSDQ-KBPBESRZSA-N
Mol Weight 280.34 g/mol
Molecular Formula C14H16O4S
Exact Mass 280.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcWQIN3lQG0
Name (S,R)-2-Ethoxy-1-ethynyl-1-p-toluenesulfonylcyclopropane
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O4S
InChI InChI=1S/C14H16O4S/c1-4-14(17-5-2)10-13(14)18-19(15,16)12-8-6-11(3)7-9-12/h1,6-9,13H,5,10H2,2-3H3/t13-,14-/m0/s1
InChIKey IJTWQVCCNSYSDQ-KBPBESRZSA-N
Molecular Weight 280.338 g/mol
SMILES [C@]1(OS(c2ccc(cc2)C)(=O)=O)([C@@](C#C)(OCC)C1)[H]
SPLASH splash10-0a4l-7900000000-dc75de0a62d3fe44dc8e
Source of Spectrum QE-2-553-23
Synonyms Toluene-4-sulfonic acid (1S,2R)-2-ethoxy-2-ethynyl-cyclopropyl ester
Wiley ID 842659