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DITHIOCARBONIC-ACID-S-[1-[(4-BROMOBENZENE-SULFONYLAMINO)-METHYL]-4-OXO-4-PIPERIDIN-1-YL-BUTYL]-ESTER-O-ETHYLESTER
SpectraBase Compound ID 37VqvBuen5v
InChI InChI=1S/C19H27BrN2O4S3/c1-2-26-28-19(27)15(6-11-18(23)22-12-4-3-5-13-22)14-21-29(24,25)17-9-7-16(20)8-10-17/h7-10,15,21H,2-6,11-14H2,1H3
InChIKey GHLCTLAPKZHZLZ-UHFFFAOYSA-N
Mol Weight 523.52 g/mol
Molecular Formula C19H27BrN2O4S3
Exact Mass 522.031634 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AUekz01mmoe
Name DITHIOCARBONIC-ACID-S-[1-[(4-BROMOBENZENE-SULFONYLAMINO)-METHYL]-4-OXO-4-PIPERIDIN-1-YL-BUTYL]-ESTER-O-ETHYLESTER
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H27BrN2O4S3
InChI InChI=1S/C19H27BrN2O4S3/c1-2-26-28-19(27)15(6-11-18(23)22-12-4-3-5-13-22)14-21-29(24,25)17-9-7-16(20)8-10-17/h7-10,15,21H,2-6,11-14H2,1H3
InChIKey GHLCTLAPKZHZLZ-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 523.518 g/mol
Sample ID 62150
Solvent CDCl3