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2-{4'-[(5''-Oxo-2'',6'',6''-trimethylcyclohex-1''-enyl)-3',4'-dioxo-2'-methylbut-2'-en-1'-yl]-2,3-dihydropyran-4-one
SpectraBase Compound ID KWMMSHOIFWd
InChI InChI=1S/C19H22O5/c1-11-5-6-15(21)19(3,4)16(11)18(23)17(22)12(2)9-14-10-13(20)7-8-24-14/h7-9,14H,5-6,10H2,1-4H3/b12-9+
InChIKey BTSPZPHFYPEDAW-FMIVXFBMSA-N
Mol Weight 330.38 g/mol
Molecular Formula C19H22O5
Exact Mass 330.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IsnTee9H4U
Name 2-{4'-[(5''-Oxo-2'',6'',6''-trimethylcyclohex-1''-enyl)-3',4'-dioxo-2'-methylbut-2'-en-1'-yl]-2,3-dihydropyran-4-one
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Formula C19H22O5
InChI InChI=1S/C19H22O5/c1-11-5-6-15(21)19(3,4)16(11)18(23)17(22)12(2)9-14-10-13(20)7-8-24-14/h7-9,14H,5-6,10H2,1-4H3/b12-9+
InChIKey BTSPZPHFYPEDAW-FMIVXFBMSA-N
Molecular Weight 330.380 g/mol
SMILES C=1(C(C(\C(=C\C2OC=CC(C2)=O)C)=O)=O)C(C(CCC1C)=O)(C)C
SPLASH splash10-014i-2900000000-ac7b22f19f4766aab4b0
Source of Spectrum AC-1993-368-35
Wiley ID 811498