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3-alpha-(2-Methylbutyryloxy)tropane
SpectraBase Compound ID LlYI6Pc4GWT
InChI InChI=1S/C13H23NO2/c1-4-9(2)13(15)16-12-7-10-5-6-11(8-12)14(10)3/h9-12H,4-8H2,1-3H3/t9?,10-,11+,12+
InChIKey OGQXAZJUVVPCRL-KVMUQPTRSA-N
Mol Weight 225.33 g/mol
Molecular Formula C13H23NO2
Exact Mass 225.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGJoQNULzPc
Name 3-alpha-(2-Methylbutyryloxy)tropane
Classification Drug precursor derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 225.172878983 u
Formula C13H23NO2
InChI InChI=1S/C13H23NO2/c1-4-9(2)13(15)16-12-7-10-5-6-11(8-12)14(10)3/h9-12H,4-8H2,1-3H3/t9?,10-,11+,12+
InChIKey OGQXAZJUVVPCRL-KVMUQPTRSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 225.332 g/mol
Nominal Mass 225 u
Quality 920
Retention Index 1570
SMILES [C@]12(N([C@](C[C@](C2)(OC(C(CC)C)=O)[H])(CC1)[H])C)[H]
SPLASH splash10-00di-4910000000-b3bfa778be79fde2016c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 8-Methyl-8-azabicyclo[3.2.1]octan-3-yl-2-methyl butyrate
Technique GC/MS
Wiley ID DD2024_018858