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3-Methylcyclododecanone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-Methylcyclododecanone
SpectraBase Compound ID 2YGRRLXPfR8
InChI InChI=1S/C13H24O/c1-12-9-7-5-3-2-4-6-8-10-13(14)11-12/h12H,2-11H2,1H3
InChIKey HIRAWQKSWAKIGQ-UHFFFAOYSA-N
Mol Weight 196.33 g/mol
Molecular Formula C13H24O
Exact Mass 196.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzS9t5fosuE
Name 3-Methylcyclododecanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O
InChI InChI=1S/C13H24O/c1-12-9-7-5-3-2-4-6-8-10-13(14)11-12/h12H,2-11H2,1H3
InChIKey HIRAWQKSWAKIGQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19941270823
Molecular Weight 196.334 g/mol
SMILES C1CCC(CC(CCCCCC1)C)=O
SPLASH splash10-05fr-9000000000-b84e4ccd7dfc09c0ca40
Source of Spectrum K-127-1492-22
Synonyms 3-Methylcyclododecan-1-one
Wiley ID 1792373