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[(5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-4-methylol-1,3-dioxolan-4-yl]methanol

View entire compound with spectra: 1 MS (GC)

[(5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-4-methylol-1,3-dioxolan-4-yl]methanol
SpectraBase Compound ID LBlu8WPGNka
InChI InChI=1S/C13H19N5O4/c1-12(2)21-8(13(4-19,5-20)22-12)3-18-7-17-9-10(14)15-6-16-11(9)18/h6-8,19-20H,3-5H2,1-2H3,(H2,14,15,16)/t8-/m0/s1
InChIKey ULTVKVPPFVYZTB-QMMMGPOBSA-N
Mol Weight 309.33 g/mol
Molecular Formula C13H19N5O4
Exact Mass 309.143704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Yi4ii6UrFM
Name [(5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-4-methylol-1,3-dioxolan-4-yl]methanol
Alternate Name(s) [(5S)-5-[(6-aminopurin-9-yl)methyl]-4-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19N5O4
InChI InChI=1S/C13H19N5O4/c1-12(2)21-8(13(4-19,5-20)22-12)3-18-7-17-9-10(14)15-6-16-11(9)18/h6-8,19-20H,3-5H2,1-2H3,(H2,14,15,16)/t8-/m0/s1
InChIKey ULTVKVPPFVYZTB-QMMMGPOBSA-N
Molecular Weight 309.326 g/mol
SMILES Nc1c2c([n](C[C@]3(C(CO)(OC(O3)(C)C)CO)[H])cn2)ncn1
SPLASH splash10-0f79-0690000000-98522ce89cefb8e4ef62
Source of Spectrum KC-0-946-12
Wiley ID 824588