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N,N'-dihexyl-5-[(2-mercaptoacetyl)amino]isophthalamide

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N,N'-dihexyl-5-[(2-mercaptoacetyl)amino]isophthalamide
SpectraBase Compound ID Hv9dj77UAnl
InChI InChI=1S/C22H35N3O3S/c1-3-5-7-9-11-23-21(27)17-13-18(15-19(14-17)25-20(26)16-29)22(28)24-12-10-8-6-4-2/h13-15,29H,3-12,16H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)
InChIKey LNWVEWJOCKVFCR-UHFFFAOYSA-N
Mol Weight 421.6 g/mol
Molecular Formula C22H35N3O3S
Exact Mass 421.239913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67wJAufwOnn
Name N,N'-dihexyl-5-[(2-mercaptoacetyl)amino]isophthalamide
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H35N3O3S
InChI InChI=1S/C22H35N3O3S/c1-3-5-7-9-11-23-21(27)17-13-18(15-19(14-17)25-20(26)16-29)22(28)24-12-10-8-6-4-2/h13-15,29H,3-12,16H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)
InChIKey LNWVEWJOCKVFCR-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 421.598 g/mol
Source File Reference MHKO20149