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2-AMINO-6-CHLORO-9-[4'-BENZYL-(1'R,4'S)-4'-HYDROXYMETHYL-2'-CYCLOPENTEN-1'-YL]-9H-PURINE
SpectraBase Compound ID 7lLE3wVErNg
InChI InChI=1S/C18H18ClN5O/c19-15-14-16(23-17(20)22-15)24(11-21-14)13-6-7-18(9-13,10-25)8-12-4-2-1-3-5-12/h1-7,11,13,25H,8-10H2,(H2,20,22,23)/t13-,18-/m0/s1
InChIKey HJNPVSBSQQCQAD-UGSOOPFHSA-N
Mol Weight 355.83 g/mol
Molecular Formula C18H18ClN5O
Exact Mass 355.119988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQlQokM9QWO
Name 2-AMINO-6-CHLORO-9-[4'-BENZYL-(1'R,4'S)-4'-HYDROXYMETHYL-2'-CYCLOPENTEN-1'-YL]-9H-PURINE
Compound Number 15C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18ClN5O
InChI InChI=1S/C18H18ClN5O/c19-15-14-16(23-17(20)22-15)24(11-21-14)13-6-7-18(9-13,10-25)8-12-4-2-1-3-5-12/h1-7,11,13,25H,8-10H2,(H2,20,22,23)/t13-,18-/m0/s1
InChIKey HJNPVSBSQQCQAD-UGSOOPFHSA-N
Literature Reference Author K.KATO,H.SUZUKI,H.TANAKA,T.MIYASAKA,M.BABA,K.YAMAGUCHI,H.AKI TA
Literature Reference Citation CHEM.PHARM.BULL.,47,1256(1999)
Literature Reference DOI 10.1248/cpb.47.1256
Molecular Weight 355.827 g/mol
Solvent CDCl3
Source File Reference UWLU8250