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exo-3-Oxobicyclo[3.2.1]oct-6-ene-2-ethanal
SpectraBase Compound ID 220BJbMg7mP
InChI InChI=1S/C10H12O2/c11-4-3-9-8-2-1-7(5-8)6-10(9)12/h1-2,4,7-9H,3,5-6H2
InChIKey HUQRPRWESRKSPZ-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPXb3RUcWQM
Name exo-3-Oxobicyclo[3.2.1]oct-6-ene-2-ethanal
Alternate Name(s) endo-3-Oxobicyclo[3.2.1]oct-6-ene-2-ethanal (3-oxobicyclo[3.2.1]oct-6-en-2-yl)acetaldehyde
CAS Registry Number 129492-12-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c11-4-3-9-8-2-1-7(5-8)6-10(9)12/h1-2,4,7-9H,3,5-6H2
InChIKey HUQRPRWESRKSPZ-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES C1(C(C2C=CC(C1)C2)CC=O)=O
SPLASH splash10-00ou-9100000000-06a14ddc7366b158f4ce
Source of Spectrum J-55-6090-11
Wiley ID 1160497