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1-(Phenylsulfonyl)-6-hydroxyhexan-2-one

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1-(Phenylsulfonyl)-6-hydroxyhexan-2-one
SpectraBase Compound ID DfWhG7gkvX7
InChI InChI=1S/C12H16O4S/c13-9-5-4-6-11(14)10-17(15,16)12-7-2-1-3-8-12/h1-3,7-8,13H,4-6,9-10H2
InChIKey JOLZVPWLHLHVLN-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 5fuB9i7A6AJ
Name 1-(Phenylsulfonyl)-6-hydroxyhexan-2-one
Alternate Name(s) 6-Hydroxy-1-(phenylsulfonyl)-2-hexanone 1-(benzenesulfonyl)-6-hydroxy-2-hexanone 1-(benzenesulfonyl)-6-hydroxyhexan-2-one 1-(benzenesulfonyl)-6-hydroxy-hexan-2-one 6-Oxidanyl-1-(phenylsulfonyl)hexan-2-one
CAS Registry Number 88703-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c13-9-5-4-6-11(14)10-17(15,16)12-7-2-1-3-8-12/h1-3,7-8,13H,4-6,9-10H2
InChIKey JOLZVPWLHLHVLN-UHFFFAOYSA-N
Molecular Weight 256.316 g/mol
SMILES OCCCCC(CS(=O)(=O)c1ccccc1)=O
SPLASH splash10-054x-9500000000-8ea30f33f811632d4f0e
Source of Spectrum J-49-1250-0
Wiley ID 1259392