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(1R*,2R*)-2-Ethynyl-2-(phenylsulfonyl)cyclopentanol
SpectraBase Compound ID 2Gg0IV6fBUf
InChI InChI=1S/C13H14O3S/c1-2-13(10-6-9-12(13)14)17(15,16)11-7-4-3-5-8-11/h1,3-5,7-8,12,14H,6,9-10H2/t12-,13+/m1/s1
InChIKey LORCJYNOULCGCE-OLZOCXBDSA-N
Mol Weight 250.31 g/mol
Molecular Formula C13H14O3S
Exact Mass 250.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHkw2GLLyUI
Name (1R*,2R*)-2-Ethynyl-2-(phenylsulfonyl)cyclopentanol
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O3S
InChI InChI=1S/C13H14O3S/c1-2-13(10-6-9-12(13)14)17(15,16)11-7-4-3-5-8-11/h1,3-5,7-8,12,14H,6,9-10H2/t12-,13+/m1/s1
InChIKey LORCJYNOULCGCE-OLZOCXBDSA-N
Molecular Weight 250.312 g/mol
SMILES O[C@]1([C@](S(=O)(=O)c2ccccc2)(C#C)CCC1)[H]
SPLASH splash10-0udi-0090000000-1331539f3c78bfd98311
Source of Spectrum F-66-3693-16cH
Wiley ID 1685439