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Atenolol 2AC
SpectraBase Compound ID 3eIywprmtQH
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
Mol Weight 350.42 g/mol
Molecular Formula C18H26N2O5
Exact Mass 350.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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