DITHIOCARBONIC-ACID-S-(1-[[ACETYL-(TOLUENE-4-SULFONYL)-AMINO]-METHYL]-4-OXO-4-PHENYLBUTYL)-ESTER-O-ETHYLESTER

SpectraBase Compound ID	JuVMuVvJl5a
InChI	InChI=1S/C23H27NO5S3/c1-4-29-31-23(30)20(12-15-22(26)19-8-6-5-7-9-19)16-24(18(3)25)32(27,28)21-13-10-17(2)11-14-21/h5-11,13-14,20H,4,12,15-16H2,1-3H3
InChIKey	JXDOLVKEKVPGTG-UHFFFAOYSA-N Google Search
Mol Weight	493.65 g/mol
Molecular Formula	C23H27NO5S3
Exact Mass	493.105136 g/mol

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SpectraBase Spectrum ID	3ngMwwPVFQU
Name	DITHIOCARBONIC-ACID-S-(1-[[ACETYL-(TOLUENE-4-SULFONYL)-AMINO]-METHYL]-4-OXO-4-PHENYLBUTYL)-ESTER-O-ETHYLESTER
Compound Number	4H
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C23H27NO5S3
InChI	InChI=1S/C23H27NO5S3/c1-4-29-31-23(30)20(12-15-22(26)19-8-6-5-7-9-19)16-24(18(3)25)32(27,28)21-13-10-17(2)11-14-21/h5-11,13-14,20H,4,12,15-16H2,1-3H3
InChIKey	JXDOLVKEKVPGTG-UHFFFAOYSA-N
Literature Reference Author	A.GHEORGHE,B.QUICLET-SIRE,X.VILA,S.Z.ZARD
Literature Reference Citation	ORG.LETTERS,7,1653(2005)
Literature Reference DOI	10.1021/ol0503642
Molecular Weight	493.651 g/mol
Sample ID	62162
Solvent	CDCl3