| SpectraBase Spectrum ID |
8Un3aq3fY7N |
| Name |
Propranolol-M 3AC |
| Classification |
Beta-Blocker |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
360.120902977 u |
| Formula |
C19H20O7 |
| InChI |
InChI=1S/C19H20O7/c1-12(20)23-10-15(25-13(2)21)11-24-18-8-9-19(26-14(3)22)17-7-5-4-6-16(17)18/h4-9,15H,10-11H2,1-3H3 |
| InChIKey |
LTWMZJHVSANJRJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
360.362 g/mol |
| SMILES |
c12c(c(OC(=O)C)ccc2OCC(OC(C)=O)COC(C)=O)cccc1 |
| SPLASH |
splash10-0a4i-3900000000-27110c6a9c28e497b971 |
| 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+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Propranolol-M (deamino-di-HO-) 3AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_936 |
