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(+)-(S)-3-(2,4-Dimethyl-5-ethoxycarbonyl-1H-pyrrol-3-yl)butyl methylsulfone
SpectraBase Compound ID CmEGIo6syoL
InChI InChI=1S/C14H23NO4S/c1-6-19-14(16)13-10(3)12(11(4)15-13)9(2)7-8-20(5,17)18/h9,15H,6-8H2,1-5H3/t9-/m0/s1
InChIKey ZEYSCACFOMQIJV-VIFPVBQESA-N
Mol Weight 301.4 g/mol
Molecular Formula C14H23NO4S
Exact Mass 301.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aL8LHwvcye
Name (+)-(S)-3-(2,4-Dimethyl-5-ethoxycarbonyl-1H-pyrrol-3-yl)butyl methylsulfone
Alternate Name(s) Ethyl 3,5-dimethyl-4-[(1S)-1-methyl-3-(methylsulfonyl)propyl]-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23NO4S
InChI InChI=1S/C14H23NO4S/c1-6-19-14(16)13-10(3)12(11(4)15-13)9(2)7-8-20(5,17)18/h9,15H,6-8H2,1-5H3/t9-/m0/s1
InChIKey ZEYSCACFOMQIJV-VIFPVBQESA-N
Molecular Weight 301.401 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)C)[C@](CCS(=O)(=O)C)(C)[H])C
SPLASH splash10-0007-0901000000-4e7d24efdf952833d339
Source of Spectrum QC-10-4328-6
Wiley ID 871803