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1-Azabicyclo[2.2.2]octane-2-carboxaldehyde, 5-ethenyl-, [4S-(4.alpha.,5.beta.)]-
SpectraBase Compound ID LxoJ2pxk8Pe
InChI InChI=1S/C10H15NO/c1-2-8-6-11-4-3-9(8)5-10(11)7-12/h2,7-10H,1,3-6H2/t8-,9+,10?/m1/s1
InChIKey XOFBWVNDQPANRR-ZDGBYWQASA-N
Mol Weight 165.24 g/mol
Molecular Formula C10H15NO
Exact Mass 165.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IokAJlYXAi8
Name 1-Azabicyclo[2.2.2]octane-2-carboxaldehyde, 5-ethenyl-, [4S-(4.alpha.,5.beta.)]-
Alternate Name(s) (4S,5S)-5-vinyl-1-azabicyclo[2.2.2]octane-2-carbaldehyde 1-aza-5-ethenylbicyclo[2.2.2]oct-2-ylcarbaldehyde
CAS Registry Number 75364-48-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO
InChI InChI=1S/C10H15NO/c1-2-8-6-11-4-3-9(8)5-10(11)7-12/h2,7-10H,1,3-6H2/t8-,9+,10?/m1/s1
InChIKey XOFBWVNDQPANRR-ZDGBYWQASA-N
Molecular Weight 165.236 g/mol
SMILES C1N2CC[C@@]([C@@]1(C=C)[H])([H])CC2C=O
SPLASH splash10-000i-0900000000-ad73a15f686aeea8c113
Source of Spectrum F-44-5910-11
Wiley ID 1161638