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2-[(3R)-3,7-dimethyloct-6-enylidene]malonic acid diethyl ester
SpectraBase Compound ID F81WqkBHSk2
InChI InChI=1S/C17H28O4/c1-6-20-16(18)15(17(19)21-7-2)12-11-14(5)10-8-9-13(3)4/h9,12,14H,6-8,10-11H2,1-5H3/t14-/m1/s1
InChIKey HYPXODQUZQMXOD-CQSZACIVSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7PWrO0CCN9C
Name 2-[(3R)-3,7-dimethyloct-6-enylidene]malonic acid diethyl ester
CAS Registry Number 106431-77-0
Comments Less than 3 mono-isotopic peaks
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Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-6-20-16(18)15(17(19)21-7-2)12-11-14(5)10-8-9-13(3)4/h9,12,14H,6-8,10-11H2,1-5H3/t14-/m1/s1
InChIKey HYPXODQUZQMXOD-CQSZACIVSA-N
Molecular Weight 296.407 g/mol
SMILES C(=CC[C@@](CCC=C(C)C)(C)[H])(C(=O)OCC)C(=O)OCC
SPLASH splash10-0udj-0090000000-53c0396da9015bd73c52
Source of Spectrum J-54-3126-9
Synonyms 2-[(3R)-3,7-dimethyloct-6-enylidene]propanedioic acid diethyl ester diethyl 2-[(3R)-3,7-dimethyloct-6-enylidene]propanedioate
Wiley ID 1299196