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(S)-2-Bis(ethoxycarbonyl)methylidene-5-phenylthiomethylpyrrolidine
SpectraBase Compound ID 676InOMUcbL
InChI InChI=1S/C18H23NO4S/c1-3-22-17(20)16(18(21)23-4-2)15-11-10-13(19-15)12-24-14-8-6-5-7-9-14/h5-9,13,19H,3-4,10-12H2,1-2H3/t13-/m0/s1
InChIKey SUIHTQYAJOCXPP-ZDUSSCGKSA-N
Mol Weight 349.45 g/mol
Molecular Formula C18H23NO4S
Exact Mass 349.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDt1NFwf7VJ
Name (S)-2-Bis(ethoxycarbonyl)methylidene-5-phenylthiomethylpyrrolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO4S
InChI InChI=1S/C18H23NO4S/c1-3-22-17(20)16(18(21)23-4-2)15-11-10-13(19-15)12-24-14-8-6-5-7-9-14/h5-9,13,19H,3-4,10-12H2,1-2H3/t13-/m0/s1
InChIKey SUIHTQYAJOCXPP-ZDUSSCGKSA-N
Molecular Weight 349.445 g/mol
SMILES N1[C@@](CCC1=C(C(=O)OCC)C(=O)OCC)(CSc1ccccc1)[H]
SPLASH splash10-001i-0900000000-869f91b3e42846ebfc07
Source of Spectrum F-59-3093-4a
Wiley ID 1677933