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N,N-BIS-(TERT.-BUTOXYCARBONYL)-2-AMINO-6-CHLORO-9-[[(1R,4S)-4-[(4S)-1,2-DIHYDROXYETHYL]-CYCLOBUT-2-EN-1-YL]-METHYL]-PUREIN

View entire compound with spectra: 1 NMR

N,N-BIS-(TERT.-BUTOXYCARBONYL)-2-AMINO-6-CHLORO-9-[[(1R,4S)-4-[(4S)-1,2-DIHYDROXYETHYL]-CYCLOBUT-2-EN-1-YL]-METHYL]-PUREIN
SpectraBase Compound ID 4NhUXo16EMk
InChI InChI=1S/C22H30ClN5O6/c1-21(2,3)33-19(31)28(20(32)34-22(4,5)6)18-25-16(23)15-17(26-18)27(11-24-15)9-12-7-8-13(12)14(30)10-29/h7-8,11-14,29-30H,9-10H2,1-6H3/t12-,13-,14+/m0/s1
InChIKey UWGPIEHKFRKKJO-MELADBBJSA-N
Mol Weight 495.96 g/mol
Molecular Formula C22H30ClN5O6
Exact Mass 495.188461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KhcyR00dgUD
Name N,N-BIS-(TERT.-BUTOXYCARBONYL)-2-AMINO-6-CHLORO-9-[[(1R,4S)-4-[(4S)-1,2-DIHYDROXYETHYL]-CYCLOBUT-2-EN-1-YL]-METHYL]-PUREIN
Compound Number 36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30ClN5O6
InChI InChI=1S/C22H30ClN5O6/c1-21(2,3)33-19(31)28(20(32)34-22(4,5)6)18-25-16(23)15-17(26-18)27(11-24-15)9-12-7-8-13(12)14(30)10-29/h7-8,11-14,29-30H,9-10H2,1-6H3/t12-,13-,14+/m0/s1
InChIKey UWGPIEHKFRKKJO-MELADBBJSA-N
Literature Reference Author R.MIRALLES-LLUMA,A.FIGUERAS,F.BUSQUE,A.ALVAREZ-LARENA,J.BALZ ARINI,M.FIGUEREDO,
Literature Reference Citation EUR.J.ORG.CHEM.,2013,7761(2013)
Literature Reference DOI 10.1002/ejoc.201301097
Molecular Weight 495.963 g/mol
Solvent CDCl3
Source File Reference UWBT20206