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2-AMINO-9-[(1'R,4'S)-4'-HYDROXYMETHYL-4'-METHYL-2'-CYCLOPENTEN-1'-YL]-9H-PURINE-6(1H)-ONE
SpectraBase Compound ID y1q9XeEE0X
InChI InChI=1S/C12H15N5O2/c1-12(5-18)3-2-7(4-12)17-6-14-8-9(17)15-11(13)16-10(8)19/h2-3,6-7,18H,4-5H2,1H3,(H3,13,15,16,19)/t7-,12+/m0/s1
InChIKey XYJSXDURBYZEDC-JVXZTZIISA-N
Mol Weight 261.28 g/mol
Molecular Formula C12H15N5O2
Exact Mass 261.122575 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FFwSTfYyjXP
Name 2-AMINO-9-[(1'R,4'S)-4'-HYDROXYMETHYL-4'-METHYL-2'-CYCLOPENTEN-1'-YL]-9H-PURINE-6(1H)-ONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15N5O2
InChI InChI=1S/C12H15N5O2/c1-12(5-18)3-2-7(4-12)17-6-14-8-9(17)15-11(13)16-10(8)19/h2-3,6-7,18H,4-5H2,1H3,(H3,13,15,16,19)/t7-,12+/m0/s1
InChIKey XYJSXDURBYZEDC-JVXZTZIISA-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 261.283 g/mol
Solvent DMSO-D6
Source File Reference UWLU8251