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1-[(2-Methylthio)-4-dodecenoyl]pyrrolidine
SpectraBase Compound ID 1lNwvUonUOS
InChI InChI=1S/C17H31NOS/c1-3-4-5-6-7-8-9-10-13-16(20-2)17(19)18-14-11-12-15-18/h9-10,16H,3-8,11-15H2,1-2H3/b10-9+
InChIKey KRVKRBRQVWRNPC-MDZDMXLPSA-N
Mol Weight 297.5 g/mol
Molecular Formula C17H31NOS
Exact Mass 297.212636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3a6xijdvsBI
Name 1-[(2-Methylthio)-4-dodecenoyl]pyrrolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H31NOS
InChI InChI=1S/C17H31NOS/c1-3-4-5-6-7-8-9-10-13-16(20-2)17(19)18-14-11-12-15-18/h9-10,16H,3-8,11-15H2,1-2H3/b10-9+
InChIKey KRVKRBRQVWRNPC-MDZDMXLPSA-N
Molecular Weight 297.501 g/mol
SMILES C(N1CCCC1)(=O)C(SC)C\C=C\CCCCCCC
SPLASH splash10-0udi-2290000000-e3e4096d53e83b077c2a
Source of Spectrum QA-45-627-3
Synonyms 1-[(4E)-2-(methylsulfanyl)-4-dodecenoyl]pyrrolidine Methyl (3E)-1-(1-pyrrolidinylcarbonyl)-3-undecenyl sulfide
Wiley ID 862917