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4-(Hydroxymethyl)-2alpha,3alpha-O-isopropylidene-1beta-(6-methoxy-9-purinyl)-4-cyclopentene-2alpha,3alpha-diol
SpectraBase Compound ID 72lnPPQN7c7
InChI InChI=1S/C15H18N4O4/c1-15(2)22-11-8(5-20)4-9(12(11)23-15)19-7-18-10-13(19)16-6-17-14(10)21-3/h4,6-7,9,11-12,20H,5H2,1-3H3/t9-,11-,12+/m1/s1
InChIKey YCRRRTNKFOIYNN-JLLWLGSASA-N
Mol Weight 318.33 g/mol
Molecular Formula C15H18N4O4
Exact Mass 318.132805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZsL6DPDiJh
Name 4-(Hydroxymethyl)-2alpha,3alpha-O-isopropylidene-1beta-(6-methoxy-9-purinyl)-4-cyclopentene-2alpha,3alpha-diol
Alternate Name(s) ((3aS,4R,6aR)-4-(6-methoxy-9H-purin-9-yl)-2,2-dimethyl-3a,6a-dihydro-4H-cyclopenta[d][1,3]dioxol-6-yl)methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N4O4
InChI InChI=1S/C15H18N4O4/c1-15(2)22-11-8(5-20)4-9(12(11)23-15)19-7-18-10-13(19)16-6-17-14(10)21-3/h4,6-7,9,11-12,20H,5H2,1-3H3/t9-,11-,12+/m1/s1
InChIKey YCRRRTNKFOIYNN-JLLWLGSASA-N
Literature Reference DOI 10.1002/hlca.19830660702
Molecular Weight 318.333 g/mol
SMILES OCC=1[C@@]2([C@]([C@@](C1)([n]1c3ncnc(c3nc1)OC)[H])(OC(O2)(C)C)[H])[H]
SPLASH splash10-03di-2920000000-6efcd33ad3f7a7594659
Source of Spectrum H-66-1920-16
Wiley ID 1794800