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(E)-(4R,5S)-3,5-Dimethoxy-4-methyl-hepta-2,6-dienoic acid methyl ester
SpectraBase Compound ID CKu6xCUbEK0
InChI InChI=1S/C11H18O4/c1-6-9(13-3)8(2)10(14-4)7-11(12)15-5/h6-9H,1H2,2-5H3/b10-7+/t8-,9+/m1/s1
InChIKey ZMXQKBFJFDIZFD-LIHZAOSCSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7bvdzghUf48
Name (E)-(4R,5S)-3,5-Dimethoxy-4-methyl-hepta-2,6-dienoic acid methyl ester
Alternate Name(s) (4R,5S,E)-methyl 3,5-dimethoxy-4-methylhepta-2,6-dienoate (2E,4R,5S)-3,5-dimethoxy-4-methylhepta-2,6-dienoic acid methyl ester Methyl (2E,4R,5S)-3,5-dimethoxy-4-methylhepta-2,6-dienoate Methyl (2E,4R,5S)-3,5-dimethoxy-4-methyl-hepta-2,6-dienoate
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Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-6-9(13-3)8(2)10(14-4)7-11(12)15-5/h6-9H,1H2,2-5H3/b10-7+/t8-,9+/m1/s1
InChIKey ZMXQKBFJFDIZFD-LIHZAOSCSA-N
Literature Reference DOI 10.1021/ol701459j
Molecular Weight 214.261 g/mol
SMILES C(\C=C/([C@](C)([C@@](OC)(C=C)[H])[H])OC)(OC)=O
SPLASH splash10-00di-9400000000-2bd71013369182ce35be
Source of Spectrum A1-9-3425/SMS4-2
Wiley ID 1758542