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Famciclovir PFP
SpectraBase Compound ID KDyqxC45ghM
InChI InChI=1S/C17H18F5N5O5/c1-9(28)31-6-11(7-32-10(2)29)3-4-27-8-24-12-5-23-15(25-13(12)27)26-14(30)16(18,19)17(20,21)22/h5,8,11H,3-4,6-7H2,1-2H3,(H,23,25,26,30)
InChIKey ZSCVUOPRACZXLK-UHFFFAOYSA-N
Mol Weight 467.35 g/mol
Molecular Formula C17H18F5N5O5
Exact Mass 467.12281 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ThcFR6RGK
Name Famciclovir PFP
Classification Virustatic
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Exact Mass 467.122809510 u
Formula C17H18N5O5F5
InChI InChI=1S/C17H18F5N5O5/c1-9(28)31-6-11(7-32-10(2)29)3-4-27-8-24-12-5-23-15(25-13(12)27)26-14(30)16(18,19)17(20,21)22/h5,8,11H,3-4,6-7H2,1-2H3,(H,23,25,26,30)
InChIKey ZSCVUOPRACZXLK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 467.353 g/mol
SMILES C(CC[n]1c2c(nc1)cnc(NC(C(F)(F)C(F)(F)F)=O)n2)(COC(C)=O)COC(=O)C
SPLASH splash10-001j-1349000000-39c22ead2b886a5aad18
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_7743