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1-(benzenesulfonyl)-3-hydroxy-1-cyclopentanecarbonitrile
SpectraBase Compound ID JtOCu06KLNc
InChI InChI=1S/C12H13NO3S/c13-9-12(7-6-10(14)8-12)17(15,16)11-4-2-1-3-5-11/h1-5,10,14H,6-8H2
InChIKey QOCJGNRQDKIDRM-UHFFFAOYSA-N
Mol Weight 251.3 g/mol
Molecular Formula C12H13NO3S
Exact Mass 251.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LF9qdTJVkFQ
Name 1-(benzenesulfonyl)-3-hydroxy-1-cyclopentanecarbonitrile
Alternate Name(s) 1-(benzenesulfonyl)-3-hydroxy-cyclopentanecarbonitrile 1-(benzenesulfonyl)-3-hydroxycyclopentane-1-carbonitrile 1-besyl-3-hydroxy-cyclopentanecarbonitrile 3-Oxidanyl-1-(phenylsulfonyl)cyclopentane-1-carbonitrile
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Formula C12H13NO3S
InChI InChI=1S/C12H13NO3S/c13-9-12(7-6-10(14)8-12)17(15,16)11-4-2-1-3-5-11/h1-5,10,14H,6-8H2
InChIKey QOCJGNRQDKIDRM-UHFFFAOYSA-N
Molecular Weight 251.300 g/mol
SMILES OC1CC(S(=O)(=O)c2ccccc2)(C#N)CC1
SPLASH splash10-004i-9800000000-8fa75b27ca31755f5f77
Source of Spectrum J-59-1524-6
Wiley ID 1254386