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1-Propanone, 1-(4-cycloocten-1-yl)-
SpectraBase Compound ID IE6cztML6It
InChI InChI=1S/C11H18O/c1-2-11(12)10-8-6-4-3-5-7-9-10/h3-4,10H,2,5-9H2,1H3/b4-3-
InChIKey CTDUSPJUYDPROA-ARJAWSKDSA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Idg5v0td0s2
Name 1-Propanone, 1-(4-cycloocten-1-yl)-
CAS Registry Number 54703-58-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O
InChI InChI=1S/C11H18O/c1-2-11(12)10-8-6-4-3-5-7-9-10/h3-4,10H,2,5-9H2,1H3/b4-3-
InChIKey CTDUSPJUYDPROA-ARJAWSKDSA-N
Molecular Weight 166.264 g/mol
SMILES CCC(=O)C1CCC\C=C/CC1
SPLASH splash10-0arc-9100000000-f44b808c03881a90866a
Source of Spectrum W5-0-0-0
Synonyms 1-(4-Cycloocten-1-yl)-1-propanone 1-[(4Z)-1-cyclooct-4-enyl]-1-propanone 1-[(4Z)-cyclooct-4-en-1-yl]propan-1-one 5-Propionylcyclooctene
Wiley ID 1162943