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(+)-(S)-3-(2,4-Dimethyl-5-ethoxycarbonyl-1H-pyrrol-3-yl)butyl methylsulfoxide
SpectraBase Compound ID F8wYHa9o8I0
InChI InChI=1S/C14H23NO3S/c1-6-18-14(16)13-10(3)12(11(4)15-13)9(2)7-8-19(5)17/h9,15H,6-8H2,1-5H3/t9-,19?/m0/s1
InChIKey WZCJPKIHRCDVBA-DUOAPZILSA-N
Mol Weight 285.4 g/mol
Molecular Formula C14H23NO3S
Exact Mass 285.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOQ6W9KZFWc
Name (+)-(S)-3-(2,4-Dimethyl-5-ethoxycarbonyl-1H-pyrrol-3-yl)butyl methylsulfoxide
Alternate Name(s) Ethyl 3,5-dimethyl-4-[(1S)-1-methyl-3-(methylsulfinyl)propyl]-1H-pyrrole-2-carboxylate
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Formula C14H23NO3S
InChI InChI=1S/C14H23NO3S/c1-6-18-14(16)13-10(3)12(11(4)15-13)9(2)7-8-19(5)17/h9,15H,6-8H2,1-5H3/t9-,19?/m0/s1
InChIKey WZCJPKIHRCDVBA-DUOAPZILSA-N
Molecular Weight 285.402 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)C)[C@](CCS(=O)C)(C)[H])C
SPLASH splash10-08fr-0970000000-eaebe32381ab8f041730
Source of Spectrum QC-10-4328-5
Wiley ID 871804