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Dimethyl [(E)-1-t-butyl-2,6,6-trimethyl-3-oxo-4-heptenyl]malonate
SpectraBase Compound ID 1AQ6LW27mg5
InChI InChI=1S/C19H32O5/c1-12(13(20)10-11-18(2,3)4)15(19(5,6)7)14(16(21)23-8)17(22)24-9/h10-12,14-15H,1-9H3/b11-10+
InChIKey UPCHHQPAIGQANW-ZHACJKMWSA-N
Mol Weight 340.5 g/mol
Molecular Formula C19H32O5
Exact Mass 340.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43XiI6M3brl
Name Dimethyl [(E)-1-t-butyl-2,6,6-trimethyl-3-oxo-4-heptenyl]malonate
Alternate Name(s) Dimethyl 2-[(4E)-1-tert-butyl-2,6,6-trimethyl-3-oxo-4-heptenyl]malonate
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Formula C19H32O5
InChI InChI=1S/C19H32O5/c1-12(13(20)10-11-18(2,3)4)15(19(5,6)7)14(16(21)23-8)17(22)24-9/h10-12,14-15H,1-9H3/b11-10+
InChIKey UPCHHQPAIGQANW-ZHACJKMWSA-N
Molecular Weight 340.460 g/mol
SMILES C(C(C(C(\C=C\C(C)(C)C)=O)C)C(C)(C)C)(C(=O)OC)C(=O)OC
SPLASH splash10-03di-0930000000-a2f75697164806b630c7
Source of Spectrum AJ-64-3002-13
Wiley ID 1335197