SpectraBase Spectrum ID |
8KYdovhl0d7 |
Name |
Emtricitabine 2TFA |
Classification |
Virustatic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
439.007288680 u |
Formula |
C12H8N3O5F7S |
InChI |
InChI=1S/C12H8F7N3O5S/c13-4-1-22(10(25)21-7(4)20-8(23)11(14,15)16)5-3-28-6(27-5)2-26-9(24)12(17,18)19/h1,5-6H,2-3H2,(H,20,21,23,25) |
InChIKey |
JEKPTFDSCXEYQA-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
439.261 g/mol |
SMILES |
C1(=O)N(C2OC(SC2)COC(C(F)(F)F)=O)C=C(F)C(NC(=O)C(F)(F)F)=N1 |
SPLASH |
splash10-0udi-5900000000-32ac83d33d0c16d40ad0 |
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_7487 |