| SpectraBase Spectrum ID |
L8X5lzC0yRq |
| Name |
Pyrrobutamine-M (oxo-) |
| Classification |
Antihistamine |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
325.123341967 u |
| Formula |
C20H20ClNO |
| InChI |
InChI=1S/C20H20ClNO/c21-19-10-8-16(9-11-19)15-18(17-5-2-1-3-6-17)12-14-22-13-4-7-20(22)23/h1-3,5-6,8-12H,4,7,13-15H2/b18-12- |
| InChIKey |
ORFURAUSBAEOCC-PDGQHHTCSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
325.839 g/mol |
| SMILES |
C(\C(=C\CN1CCCC1=O)c1ccccc1)c1ccc(cc1)Cl |
| SPLASH |
splash10-0pxv-6890000000-455afc7a56d7a64cf679 |
| 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. |
| Sample Preparation Procedure |
Detected: U UHY UHYAC |
| 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_2205 |
