1-[(2-Methylthio)-4-eicosenoyl]pyrrolidine

SpectraBase Compound ID	5LUOm95Y7U0
InChI	InChI=1S/C25H47NOS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(28-2)25(27)26-22-19-20-23-26/h17-18,24H,3-16,19-23H2,1-2H3/b18-17+
InChIKey	RNSAOLBCTVEUMR-ISLYRVAYSA-N Google Search
Mol Weight	409.7 g/mol
Molecular Formula	C25H47NOS
Exact Mass	409.337836 g/mol

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SpectraBase Spectrum ID	5pmUwfWDqOQ
Name	1-[(2-Methylthio)-4-eicosenoyl]pyrrolidine
Alternate Name(s)	1-[(4E)-2-(methylsulfanyl)-4-icosenoyl]pyrrolidine Methyl (3E)-1-(1-pyrrolidinylcarbonyl)-3-nonadecenyl sulfide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H47NOS
InChI	InChI=1S/C25H47NOS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(28-2)25(27)26-22-19-20-23-26/h17-18,24H,3-16,19-23H2,1-2H3/b18-17+
InChIKey	RNSAOLBCTVEUMR-ISLYRVAYSA-N
Molecular Weight	409.717 g/mol
SMILES	C(N1CCCC1)(=O)C(SC)C\C=C\CCCCCCCCCCCCCCC
SPLASH	splash10-03di-8809000000-de2b556dbc426f4b70d1
Source of Spectrum	QA-45-627-3
Wiley ID	862916