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Omeprazole-A
SpectraBase Compound ID BNIU4LH5XtP
InChI InChI=1S/C9H13NO/c1-6-5-10-8(3)7(2)9(6)11-4/h5H,1-4H3
InChIKey LELDJUYQEMKHJH-UHFFFAOYSA-N
Mol Weight 151.21 g/mol
Molecular Formula C9H13NO
Exact Mass 151.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hf9a7XDqWnJ
Name Omeprazole-A
Classification Pharmaceutical drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 151.099714042 u
Formula C9H13NO
InChI InChI=1S/C9H13NO/c1-6-5-10-8(3)7(2)9(6)11-4/h5H,1-4H3
InChIKey LELDJUYQEMKHJH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 151.209 g/mol
Nominal Mass 151 u
Quality 984
Retention Index 1165
SMILES C1(=C(C(=NC=C1C)C)C)OC
SPLASH splash10-0udr-6900000000-0c15f6c758d214a854df
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Methoxy-2,3,5-trimethylpyridine
Technique GC/MS
Wiley ID DD2024_029634