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2'-Deoxyadenosine 3TMS
SpectraBase Compound ID 96TryYYofUA
InChI InChI=1S/C19H37N5O3Si3/c1-28(2,3)23-18-17-19(21-12-20-18)24(13-22-17)16-10-14(27-30(7,8)9)15(26-16)11-25-29(4,5)6/h12-16H,10-11H2,1-9H3,(H,20,21,23)
InChIKey PSEZCYIEJIOFHY-UHFFFAOYSA-N
Mol Weight 467.8 g/mol
Molecular Formula C19H37N5O3Si3
Exact Mass 467.22042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuDye2CiySw
Name 2'-deoxyguanosine, 3TMS
Comments Derivatization type: 3 TMS (mass: 483.215); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000171; Note: The molecular formula of the structure shown is C10H13N5O3 - which differs from the formula reported for the mass spectrum (C19H37N5O3Si3)
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Formula C19H37N5O3Si3
InChI InChI=1S/C19H37N5O3Si3/c1-28(2,3)23-18-17-19(21-12-20-18)24(13-22-17)16-10-14(27-30(7,8)9)15(26-16)11-25-29(4,5)6/h12-16H,10-11H2,1-9H3,(H,20,21,23)
InChIKey PSEZCYIEJIOFHY-UHFFFAOYSA-N
Molecular Weight 467.792 g/mol
SMILES N(c1c2c(ncn1)[n](cn2)C1CC(C(CO[Si](C)(C)C)O1)O[Si](C)(C)C)[Si](C)(C)C
SPLASH splash10-0kmi-1970000000-421a1b8f073c7ecf54fc
Source of Spectrum FM-2019-171-0
Synonyms deoxyadenosine, 3TMS Desoxyadenosine, 3TMS 2'-deoxyadenosine, 3TMS 2-Deoxyadenosine, 3TMS Adenyldeoxyriboside, 3TMS Adenine deoxyribose, 3TMS 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol, 3TMS N-(trimethylsilyl)-9-(4-((trimethylsilyl)oxy)-5-(((trimethylsilyl)oxy)methyl)tetrahydrofuran-2-yl)-9H-purin-6-amine
Wiley ID 1817862