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9-formyl-9-azabicyclo[3.3.1]nonan-3-one
SpectraBase Compound ID 9qaDMtpyvCf
InChI InChI=1S/C9H13NO2/c11-6-10-7-2-1-3-8(10)5-9(12)4-7/h6-8H,1-5H2/t7-,8+
InChIKey BGGSBZQNJSPUHP-OCAPTIKFSA-N
Mol Weight 167.21 g/mol
Molecular Formula C9H13NO2
Exact Mass 167.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOTVBrxhzKK
Name 9-formyl-9-azabicyclo[3.3.1]nonan-3-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO2
InChI InChI=1S/C9H13NO2/c11-6-10-7-2-1-3-8(10)5-9(12)4-7/h6-8H,1-5H2/t7-,8+
InChIKey BGGSBZQNJSPUHP-OCAPTIKFSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201909005
Molecular Weight 167.208 g/mol
SMILES [C@@]12(CCC[C@@](CC(C2)=O)(N1C=O)[H])[H]
SPLASH splash10-00ls-9200000000-c1e3c20d5612aadd39c6
Source of Spectrum ACI-58-SM9-28b
Wiley ID 1875672