For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Telbivudine 2PFP
SpectraBase Compound ID 4r4vOqUmNce
InChI InChI=1S/C16H12F10N2O7/c1-5-3-28(12(32)27-9(5)29)8-2-6(35-11(31)14(19,20)16(24,25)26)7(34-8)4-33-10(30)13(17,18)15(21,22)23/h3,6-8H,2,4H2,1H3,(H,27,29,32)
InChIKey AQOSPBMMEKLCDH-UHFFFAOYSA-N
Mol Weight 534.26 g/mol
Molecular Formula C16H12F10N2O7
Exact Mass 534.048482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2IeHSJUzRN8
Name Telbivudine 2PFP
Classification Virustatic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 534.048482357 u
Formula C16H12N2O7F10
InChI InChI=1S/C16H12F10N2O7/c1-5-3-28(12(32)27-9(5)29)8-2-6(35-11(31)14(19,20)16(24,25)26)7(34-8)4-33-10(30)13(17,18)15(21,22)23/h3,6-8H,2,4H2,1H3,(H,27,29,32)
InChIKey AQOSPBMMEKLCDH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 534.263 g/mol
SMILES C(C(C(OCC1C(CC(N2C(=O)NC(C(=C2)C)=O)O1)OC(=O)C(F)(F)C(F)(F)F)=O)(F)F)(F)(F)F
SPLASH splash10-00pi-7910000000-0dc36bc418bd187c1a57
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_9432