| SpectraBase Spectrum ID |
2hNoZABtLc |
| Name |
Scopolamine HFB |
| Classification |
Anticholinergic |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
499.122969884 u |
| Formula |
C21H20NO5F7 |
| InChI |
InChI=1S/C21H20F7NO5/c1-29-13-7-11(8-14(29)16-15(13)34-16)33-17(30)12(10-5-3-2-4-6-10)9-32-18(31)19(22,23)20(24,25)21(26,27)28/h2-6,11-16H,7-9H2,1H3/t11?,12?,13-,14+,15?,16? |
| InChIKey |
CVHHQTDQNVDUSE-QUFRNCFNSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
499.382 g/mol |
| SMILES |
CN1[C@]2(C3OC3[C@@]1(CC(OC(C(COC(C(F)(F)C(F)(F)C(F)(F)F)=O)c1ccccc1)=O)C2)[H])[H] |
| SPLASH |
splash10-0f7c-8900000000-793049bf41ef787473b4 |
| 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_8128 |
