| SpectraBase Spectrum ID |
JJ7CKGgF1WK |
| Name |
Esmolol 2AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
379.199487652 u |
| Formula |
C20H29NO6 |
| InChI |
InChI=1S/C20H29NO6/c1-14(2)21(15(3)22)12-19(27-16(4)23)13-26-18-9-6-17(7-10-18)8-11-20(24)25-5/h6-7,9-10,14,19H,8,11-13H2,1-5H3 |
| InChIKey |
YJQRTIZDUDDGIB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
379.453 g/mol |
| Nominal Mass |
379 u |
| Quality |
899 |
| Retention Index |
2774 |
| SMILES |
C(N(C(=O)C)C(C)C)C(COC=1C=CC(=CC1)CCC(OC)=O)OC(=O)C |
| SPLASH |
splash10-0udj-5960000000-94879278baa82de21e43 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 3-(4-(2-(acetyloxy)-3-(acetyl(propan-2-yl)amino)propoxy)phenyl)propanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007941 |
