SpectraBase Spectrum ID |
DlodzfTAOtk |
Name |
Atenolol 2AC |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
350.184171940 u |
Formula |
C18H26N2O5 |
InChI |
InChI=1S/C18H26N2O5/c1-12(2)20(13(3)21)10-17(25-14(4)22)11-24-16-7-5-15(6-8-16)9-18(19)23/h5-8,12,17H,9-11H2,1-4H3,(H2,19,23) |
InChIKey |
QRLMZEGBCRPZKY-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
350.415 g/mol |
Nominal Mass |
350 u |
Quality |
712 |
Retention Index |
2637 |
SMILES |
NC(CC1=CC=C(OCC(CN(C(=O)C)C(C)C)OC(=O)C)C=C1)=O |
SPLASH |
splash10-0udi-5950000000-c1faa151545b935f16c0 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(acetyl(propan-2-yl)amino)-3-(4-(2-amino-2-oxoethyl)phenoxy)propan-2-yl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_007987 |