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Dimethyl (3-methyl-2-cyclohexen-1-yl)malonate
SpectraBase Compound ID BHF6KiTDI5X
InChI InChI=1S/C12H18O4/c1-8-5-4-6-9(7-8)10(11(13)15-2)12(14)16-3/h7,9-10H,4-6H2,1-3H3
InChIKey YPTMNRYBEHQCHB-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eLdojjpZgP
Name Dimethyl (3-methyl-2-cyclohexen-1-yl)malonate
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-8-5-4-6-9(7-8)10(11(13)15-2)12(14)16-3/h7,9-10H,4-6H2,1-3H3
InChIKey YPTMNRYBEHQCHB-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C(C(C(=O)OC)C1C=C(CCC1)C)(=O)OC
SPLASH splash10-0002-9000000000-6e84816c7262c406310a
Source of Spectrum J-64-2747-47
Synonyms dimethyl 2-(3-methyl-2-cyclohexen-1-yl)malonate 2-(3-methyl-1-cyclohex-2-enyl)propanedioic acid dimethyl ester dimethyl 2-(3-methylcyclohex-2-en-1-yl)propanedioate
Wiley ID 1529838