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Inosine 4TMS
SpectraBase Compound ID 9rw3oV4iva1
InChI InChI=1S/C22H44N4O5Si4/c1-32(2,3)27-13-16-18(29-33(4,5)6)19(30-34(7,8)9)22(28-16)26-15-25-17-20(26)23-14-24-21(17)31-35(10,11)12/h14-16,18-19,22H,13H2,1-12H3
InChIKey LEZIDMDMEIMSNO-UHFFFAOYSA-N
Mol Weight 557.0 g/mol
Molecular Formula C22H44N4O5Si4
Exact Mass 556.238877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gbTh3jD6m
Name inosine, 4TMS
Comments Derivatization type: 4 TMS (mass: 556.239); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000277; Note: The molecular formula of the structure shown is C10H12N4O5 - which differs from the formula reported for the mass spectrum (C22H44N4O5Si4)
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Formula C22H44N4O5Si4
InChI InChI=1S/C22H44N4O5Si4/c1-32(2,3)27-13-16-18(29-33(4,5)6)19(30-34(7,8)9)22(28-16)26-15-25-17-20(26)23-14-24-21(17)31-35(10,11)12/h14-16,18-19,22H,13H2,1-12H3
InChIKey LEZIDMDMEIMSNO-UHFFFAOYSA-N
Molecular Weight 556.957 g/mol
SMILES C(C1C(C(C([n]2cnc3c2ncnc3O[Si](C)(C)C)O1)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-0frt-0970000000-0bba21a9f74dcc40b0e8
Source of Spectrum FM-2019-277-0
Synonyms riboxine, 4TMS Hypoxanthosine, 4TMS Ribonosine, 4TMS Trophicardyl, 4TMS Oxiamin, 4TMS 9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one, 4TMS 9-(3,4-bis((trimethylsilyl)oxy)-5-(((trimethylsilyl)oxy)methyl)tetrahydrofuran-2-yl)-6-((trimethylsilyl)oxy)-9H-purine
Wiley ID 1817965