| SpectraBase Spectrum ID |
6gRwS8eklrt |
| Name |
Tipranavir artifact-3 (-C3H8) |
| CAS Registry Number |
174484-41-4 |
| Classification |
Virustatic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
558.143627571 u |
| Formula |
C28H25F3N2O5S |
| InChI |
InChI=1S/C28H25F3N2O5S/c1-2-23(26-24(34)16-22(38-27(26)35)14-8-18-6-4-3-5-7-18)19-9-12-21(13-10-19)33-39(36,37)25-15-11-20(17-32-25)28(29,30)31/h3-7,9-13,15-17,23,33,35H,2,8,14H2,1H3 |
| InChIKey |
OPWIINNLMGYLIE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
558.572 g/mol |
| SMILES |
C(c1ccc(nc1)S(Nc1ccc(cc1)C(CC)C1=C(OC(=CC1=O)CCc1ccccc1)O)(=O)=O)(F)(F)F |
| SPLASH |
splash10-0036-5921000000-b78da877073a3384c3f1 |
| 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_7918 |
