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N-ALLYLOXYCARBONYLGLYCYL-S-HEXADECYL-L-CYSTEINE-TERT.-BUTYLESTER
SpectraBase Compound ID 9bDxwLliVft
InChI InChI=1S/C29H54N2O5S/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-37-24-25(27(33)36-29(3,4)5)31-26(32)23-30-28(34)35-21-7-2/h7,25H,2,6,8-24H2,1,3-5H3,(H,30,34)(H,31,32)/t25-/m0/s1
InChIKey UHTYIEIKSRTOKN-VWLOTQADSA-N
Mol Weight 542.8 g/mol
Molecular Formula C29H54N2O5S
Exact Mass 542.375344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GnTsD7egfvM
Name N-ALLYLOXYCARBONYLGLYCYL-S-HEXADECYL-L-CYSTEINE-TERT.-BUTYLESTER
Compound Number 25B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H54N2O5S
InChI InChI=1S/C29H54N2O5S/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-37-24-25(27(33)36-29(3,4)5)31-26(32)23-30-28(34)35-21-7-2/h7,25H,2,6,8-24H2,1,3-5H3,(H,30,34)(H,31,32)/t25-/m0/s1
InChIKey UHTYIEIKSRTOKN-VWLOTQADSA-N
Literature Reference Author K.KUHN,D.J.OWEN,B.BADER,A.WITTINGHOFER,J.KUHLMANN,H.WALDMANN
Literature Reference Citation J.AM.CHEM.SOC.,123,1023(2001)
Literature Reference DOI 10.1021/ja002723o
Molecular Weight 542.818 g/mol
Solvent CDCl3
Source File Reference UWSI23429