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3-Methyl-cyclopentadecane-1,5-dione

View entire compound with spectra: 1 NMR, 2 FTIR, and 2 MS (GC)

3-Methyl-cyclopentadecane-1,5-dione
SpectraBase Compound ID As5aoMldw3P
InChI InChI=1S/C16H28O2/c1-14-12-15(17)10-8-6-4-2-3-5-7-9-11-16(18)13-14/h14H,2-13H2,1H3
InChIKey FRTDAFYYAIXLRJ-UHFFFAOYSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CnapotM6Cp8
Name 1,5-Cyclopentadecanedione, 3-methyl-
CAS Registry Number 21890-10-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-14-12-15(17)10-8-6-4-2-3-5-7-9-11-16(18)13-14/h14H,2-13H2,1H3
InChIKey FRTDAFYYAIXLRJ-UHFFFAOYSA-N
Molecular Weight 252.398 g/mol
SMILES C1(=O)CC(CC(=O)CCCCCCCCCC1)C
SPLASH splash10-0fr2-9420000000-4e9a52bc98ba4aca3ee4
Source of Spectrum H-60-1978-0
Synonyms 3-Methylcyclopentadecane-1,5-dione 3-Methylcyclopentadecane-1,5-quinone
Wiley ID 1256123