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(1S,2R)-1-(1-Benzenesulfonyl-cyclopentyl)-2-methyl-propane-1,3-diol
SpectraBase Compound ID 6nQ6Q4s3KeK
InChI InChI=1S/C15H22O4S/c1-12(11-16)14(17)15(9-5-6-10-15)20(18,19)13-7-3-2-4-8-13/h2-4,7-8,12,14,16-17H,5-6,9-11H2,1H3/t12-,14+/m1/s1
InChIKey UUAHIWCZJNQPCL-OCCSQVGLSA-N
Mol Weight 298.4 g/mol
Molecular Formula C15H22O4S
Exact Mass 298.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQDnxG0MOuM
Name (1S,2R)-1-(1-Benzenesulfonyl-cyclopentyl)-2-methyl-propane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O4S
InChI InChI=1S/C15H22O4S/c1-12(11-16)14(17)15(9-5-6-10-15)20(18,19)13-7-3-2-4-8-13/h2-4,7-8,12,14,16-17H,5-6,9-11H2,1H3/t12-,14+/m1/s1
InChIKey UUAHIWCZJNQPCL-OCCSQVGLSA-N
Molecular Weight 298.397 g/mol
SMILES OC[C@]([C@@](C1(S(=O)(=O)c2ccccc2)CCCC1)(O)[H])(C)[H]
SPLASH splash10-05mk-9600000000-759cb156b0272e224b23
Source of Spectrum K-2001-2990-27
Synonyms (1S,2R)-2-methyl-1-[1-(phenylsulfonyl)cyclopentyl]-1,3-propanediol (2S*,3S*)-2-Methyl-3-(1'-phenylsulfonylcyclopentyl)propane-1,3-diol (1S,2R)-1-[1-(benzenesulfonyl)cyclopentyl]-2-methylpropane-1,3-diol (1S,2R)-1-[1-(benzenesulfonyl)cyclopentyl]-2-methyl-propane-1,3-diol (1S,2R)-2-methyl-1-[1-(phenylsulfonyl)cyclopentyl]propane-1,3-diol
Wiley ID 1580062