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Tropinone
SpectraBase Compound ID 3MZGOuEctJw
InChI InChI=1S/C8H13NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-7H,2-5H2,1H3/t6-,7+
InChIKey QQXLDOJGLXJCSE-KNVOCYPGSA-N
Mol Weight 139.2 g/mol
Molecular Formula C8H13NO
Exact Mass 139.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KIUX2OtRia
Name Tropinone
CAS Registry Number 532-24-1
Classification Drug precursor
Comments Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 139.099714042 u
Formula C8H13NO
InChI InChI=1S/C8H13NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-7H,2-5H2,1H3/t6-,7+
InChIKey QQXLDOJGLXJCSE-KNVOCYPGSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 139.198 g/mol
Nominal Mass 139 u
Quality 970
Retention Index 1111
SMILES [C@]12(N([C@](CC(C2)=O)(CC1)[H])C)[H]
SPLASH splash10-001i-9000000000-b0114b219df4208c8065
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 8-Methyl-8-azabicyclo[3.2.1]octan-3-one
Technique GC/MS
Wiley ID DD2024_024959