| SpectraBase Spectrum ID |
3G8zWGcygen |
| Name |
Oxprenolol-M (HO-) isomer-2 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 |
407.194402271 u |
| Formula |
C21H29NO7 |
| InChI |
InChI=1S/C21H29NO7/c1-7-10-26-21-11-18(28-16(5)24)8-9-20(21)27-13-19(29-17(6)25)12-22(14(2)3)15(4)23/h7-9,11,14,19H,1,10,12-13H2,2-6H3 |
| InChIKey |
SQLPLEJOYVMUSJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
407.463 g/mol |
| SMILES |
c1c(OCC(OC(=O)C)CN(C(C)C)C(=O)C)c(OCC=C)cc(OC(=O)C)c1 |
| SPLASH |
splash10-0znc-9882000000-92f398e31d3e7a2d5152 |
| 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: 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_1341 |
