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2-Benzenesulfonylmethyl-1-methyl-cyclopentanecarboxylic acid ethyl ester
SpectraBase Compound ID 9PK3nQMEvgu
InChI InChI=1S/C16H22O4S/c1-3-20-15(17)16(2)11-7-8-13(16)12-21(18,19)14-9-5-4-6-10-14/h4-6,9-10,13H,3,7-8,11-12H2,1-2H3
InChIKey FDXPUKFOMJHIQR-UHFFFAOYSA-N
Mol Weight 310.41 g/mol
Molecular Formula C16H22O4S
Exact Mass 310.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIpRBuykVgM
Name 2-Benzenesulfonylmethyl-1-methyl-cyclopentanecarboxylic acid ethyl ester
Alternate Name(s) Ethyl 1-methyl-2-phenylthiomethylcyclopentanecarboxylate Ethyl 1-methyl-2-[(phenylsulfonyl)methyl]cyclopentanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4S
InChI InChI=1S/C16H22O4S/c1-3-20-15(17)16(2)11-7-8-13(16)12-21(18,19)14-9-5-4-6-10-14/h4-6,9-10,13H,3,7-8,11-12H2,1-2H3
InChIKey FDXPUKFOMJHIQR-UHFFFAOYSA-N
Molecular Weight 310.408 g/mol
SMILES C(S(=O)(=O)c1ccccc1)C1C(C(=O)OCC)(CCC1)C
SPLASH splash10-014j-9720000000-d108e7324a04dd97d7ae
Source of Spectrum F-54-2807-21
Wiley ID 806373