| SpectraBase Spectrum ID |
GXGWwnE2Wx6 |
| Name |
Penbutolol 2AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
375.240958543 u |
| Formula |
C22H33NO4 |
| InChI |
InChI=1S/C22H33NO4/c1-16(24)23(22(3,4)5)14-19(27-17(2)25)15-26-21-13-9-8-12-20(21)18-10-6-7-11-18/h8-9,12-13,18-19H,6-7,10-11,14-15H2,1-5H3 |
| InChIKey |
PSAZFLFWDPVWMY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
375.509 g/mol |
| Nominal Mass |
375 u |
| Quality |
879 |
| Retention Index |
2798 |
| SMILES |
C(N(CC(COC=1C(C2CCCC2)=CC=CC1)OC(=O)C)C(=O)C)(C)(C)C |
| SPLASH |
splash10-0udl-3940000000-df5da036338a4845a663 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(acetyl(tert-butyl)amino)-3-(2-cyclopentylphenoxy)propan-2-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007962 |
