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Valganciclovir 5TMS
SpectraBase Compound ID 6xiR1H6qMwC
InChI InChI=1S/C29H62N6O5Si5/c1-22(2)25(34(41(3,4)5)42(6,7)8)28(37)38-18-23(19-40-45(15,16)17)39-21-33-20-30-24-26(33)31-29(32-27(24)36)35(43(9,10)11)44(12,13)14/h20,22-23,25H,18-19,21H2,1-17H3,(H,31,32,36)
InChIKey VZEWIEURCNXGHB-UHFFFAOYSA-N
Mol Weight 715.3 g/mol
Molecular Formula C29H62N6O5Si5
Exact Mass 714.362802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LViNuFCD5HY
Name Valganciclovir 5TMS
Classification Virustatic
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Exact Mass 714.362801790 u
Formula C29H62N6O5Si5
InChI InChI=1S/C29H62N6O5Si5/c1-22(2)25(34(41(3,4)5)42(6,7)8)28(37)38-18-23(19-40-45(15,16)17)39-21-33-20-30-24-26(33)31-29(32-27(24)36)35(43(9,10)11)44(12,13)14/h20,22-23,25H,18-19,21H2,1-17H3,(H,31,32,36)
InChIKey VZEWIEURCNXGHB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 715.277 g/mol
Related CAS Registry Number(s) 175865-60-8
SMILES C1(NC(=Nc2[n](cnc12)COC(COC(C(N([Si](C)(C)C)[Si](C)(C)C)C(C)C)=O)CO[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)=O
SPLASH splash10-006x-3924101000-17a8eb5966e720179136
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_7311