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4-((4R,6S,7S)-6-Hydroxy-4,10,11,11-tetramethyl-5,9-dioxo-bicyclo[5.3.1]undec-1(10)-en-4-yl)-butyraldehyde
SpectraBase Compound ID 1vvpYjRCTSs
InChI InChI=1S/C19H28O4/c1-12-13-7-9-19(4,8-5-6-10-20)17(23)16(22)14(11-15(12)21)18(13,2)3/h10,14,16,22H,5-9,11H2,1-4H3/t14-,16+,19-/m1/s1
InChIKey VGQYEWFREHDNHV-SIXWZSSISA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCP77tfg9lI
Name 4-((4R,6S,7S)-6-Hydroxy-4,10,11,11-tetramethyl-5,9-dioxo-bicyclo[5.3.1]undec-1(10)-en-4-yl)-butyraldehyde
Alternate Name(s) 4-(4',8',11',11-Tetramethyl-2'-hydroxy-5',9'-dioxobicyclo[5.3.1]undec-7'-en-4'-yl)-butyraldehyde 4-[(1S,2S,4R)-2-hydroxy-4,8,11,11-tetramethyl-3,9-dioxobicyclo[5.3.1]undec-7-en-4-yl]butanal
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Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-12-13-7-9-19(4,8-5-6-10-20)17(23)16(22)14(11-15(12)21)18(13,2)3/h10,14,16,22H,5-9,11H2,1-4H3/t14-,16+,19-/m1/s1
InChIKey VGQYEWFREHDNHV-SIXWZSSISA-N
Molecular Weight 320.429 g/mol
SMILES O[C@]1([C@@]2(C(C(=C(C(C2)=O)C)CC[C@](C1=O)(CCCC=O)C)(C)C)[H])[H]
SPLASH splash10-001m-1930000000-97003ec2aa9ab5c9aced
Source of Spectrum B-57-64-50
Wiley ID 1551361