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BOC-PHE-CYS(ME)-SER(TERT.-BUTYL)-O(TERT.-BUTYL)
SpectraBase Compound ID Gtrw2HIEi4G
InChI InChI=1S/C29H47N3O7S/c1-27(2,3)37-17-21(25(35)38-28(4,5)6)30-24(34)22(18-40-10)31-23(33)20(16-19-14-12-11-13-15-19)32-26(36)39-29(7,8)9/h11-15,20-22H,16-18H2,1-10H3,(H,30,34)(H,31,33)(H,32,36)/t20?,21?,22-/m1/s1
InChIKey HYUFFFQIVCELJW-LZBANZJXSA-N
Mol Weight 581.8 g/mol
Molecular Formula C29H47N3O7S
Exact Mass 581.313472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HPrYPSdHPqE
Name BOC-PHE-CYS(ME)-SER(TERT.-BUTYL)-O(TERT.-BUTYL)
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H47N3O7S
InChI InChI=1S/C29H47N3O7S/c1-27(2,3)37-17-21(25(35)38-28(4,5)6)30-24(34)22(18-40-10)31-23(33)20(16-19-14-12-11-13-15-19)32-26(36)39-29(7,8)9/h11-15,20-22H,16-18H2,1-10H3,(H,30,34)(H,31,33)(H,32,36)/t20?,21?,22-/m1/s1
InChIKey HYUFFFQIVCELJW-LZBANZJXSA-N
Literature Reference Author M.MATTEUCCI,G.BHALAY,M.BRADLEY
Literature Reference Citation ORG.LETTERS,5,235(2003)
Literature Reference DOI 10.1021/ol026947i
Molecular Weight 581.768 g/mol
Sample ID 48036
Solvent CDCl3