| SpectraBase Spectrum ID |
7CFQ6oLaepY |
| Name |
Eletriptan HFB |
| Classification |
Antimigraine |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
578.147410985 u |
| Formula |
C26H25N2O3SF7 |
| InChI |
InChI=1S/C26H25F7N2O3S/c1-34-12-5-6-19(34)15-18-16-35(23(36)24(27,28)25(29,30)26(31,32)33)22-10-9-17(14-21(18)22)11-13-39(37,38)20-7-3-2-4-8-20/h2-4,7-10,14,16,19H,5-6,11-13,15H2,1H3 |
| InChIKey |
OVLSUSHHKVVJIH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
578.546 g/mol |
| SMILES |
c1cc(S(CCc2cc3c(c[n](c3cc2)C(C(F)(F)C(F)(F)C(F)(F)F)=O)CC2CCCN2C)(=O)=O)ccc1 |
| SPLASH |
splash10-001i-9100000000-d258dcc448d0243d1095 |
| 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_7494 |
