SpectraBase Spectrum ID |
HCAcyKOIZqP |
Name |
Carteolol-M (HO-) 2AC |
Classification |
Beta-Blocker |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
392.194736624 u |
Formula |
C20H28N2O6 |
InChI |
InChI=1S/C20H28N2O6/c1-12(23)27-14-8-17-16(6-7-19(25)22-17)18(9-14)26-11-15(28-13(2)24)10-21-20(3,4)5/h8-9,15,21H,6-7,10-11H2,1-5H3,(H,22,25) |
InChIKey |
FEALNAPRGXKZNV-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
392.452 g/mol |
SMILES |
c12CCC(Nc1cc(cc2OCC(CNC(C)(C)C)OC(=O)C)OC(=O)C)=O |
SPLASH |
splash10-002r-9324000000-3293c97e44c1808c045b |
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_1597 |