| SpectraBase Spectrum ID |
3xhGwapOe8 |
| Name |
Brivudine 2TFA |
| Classification |
Virustatic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
523.965382673 u |
| Formula |
C15H11N2O7BrF6 |
| InChI |
InChI=1S/C15H11BrF6N2O7/c16-2-1-6-4-24(13(28)23-10(6)25)9-3-7(31-12(27)15(20,21)22)8(30-9)5-29-11(26)14(17,18)19/h1-2,4,7-9H,3,5H2,(H,23,25,28)/b2-1+ |
| InChIKey |
XCXZKXKRJVMZEZ-OWOJBTEDSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
525.154 g/mol |
| Related CAS Registry Number(s) |
69304-47-8 |
| SMILES |
C1(CC(C(COC(=O)C(F)(F)F)O1)OC(=O)C(F)(F)F)N1C=C(\C=C\Br)C(NC1=O)=O |
| SPLASH |
splash10-0019-9710000000-a7ec748fc9b52852ee85 |
| 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_8216 |
