| SpectraBase Spectrum ID |
5O9zClZWhAA |
| Name |
Pyrrobutamine |
| CAS Registry Number |
91-82-7 |
| Classification |
Antihistamine |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
311.144077412 u |
| Formula |
C20H22ClN |
| InChI |
InChI=1S/C20H22ClN/c21-20-10-8-17(9-11-20)16-19(18-6-2-1-3-7-18)12-15-22-13-4-5-14-22/h1-3,6-12H,4-5,13-16H2/b19-12- |
| InChIKey |
WDYYVNNRTDZKAZ-UNOMPAQXSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
311.856 g/mol |
| SMILES |
C(\C(=C\CN1CCCC1)c1ccccc1)c1ccc(cc1)Cl |
| SPLASH |
splash10-0a4l-7890000000-17826338f2c5ce0b4260 |
| 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_2204 |
![Pyrrolidine, 1-[4-(4-chlorophenyl)-3-phenyl-2-butenyl]-](/api/spectrum/5O9zClZWhAA/structure.png?h=300&w=458 "Pyrrolidine, 1-[4-(4-chlorophenyl)-3-phenyl-2-butenyl]-")
