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2-Cyclononen-1-one, 7-acetyl-3-methyl-9-(1-methylethylidene)-, (Z)-(.+-.)-
SpectraBase Compound ID CGTVleXMcYJ
InChI InChI=1S/C15H22O2/c1-10(2)14-9-13(12(4)16)7-5-6-11(3)8-15(14)17/h8,13H,5-7,9H2,1-4H3/b11-8-
InChIKey QOQMBQRGIRSYJQ-FLIBITNWSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pqdZQHWjo9
Name 2-Cyclononen-1-one, 7-acetyl-3-methyl-9-(1-methylethylidene)-, (Z)-(.+-.)-
Alternate Name(s) (2Z)-7-acetyl-3-methyl-9-propan-2-ylidene-1-cyclonon-2-enone 1-methyl-6-(1-oxoethyl)-3-oxo-4-prop-2-ylidenecyclononene (2Z)-7-acetyl-9-isopropylidene-3-methyl-cyclonon-2-en-1-one 1-methyl-6-acetyl-3-oxo-4-(1-methylethylene)bicyclo[4.3.0]nonane (2Z)-7-acetyl-3-methyl-9-propan-2-ylidenecyclonon-2-en-1-one (2Z)-7-ethanoyl-3-methyl-9-propan-2-ylidene-cyclonon-2-en-1-one
CAS Registry Number 125506-07-2
Comments Less than 3 mono-isotopic peaks
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Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-10(2)14-9-13(12(4)16)7-5-6-11(3)8-15(14)17/h8,13H,5-7,9H2,1-4H3/b11-8-
InChIKey QOQMBQRGIRSYJQ-FLIBITNWSA-N
Molecular Weight 234.339 g/mol
SMILES C1(C(\C=C/(CCCC(C1)C(=O)C)C)=O)=C(C)C
SPLASH splash10-014i-0090000000-e27db5095469f863b16d
Source of Spectrum F-45-3887-14
Wiley ID 1236404