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METHYL-(2Z,4E)-5-(1'-HYDROXY-4'-METHOXYCARBONYLOXY-2',6',6'-TRIMETHYLCYCLOHEXA-2',4'-DIENYL)-3-METHYLPENTA-2,4-DIENOATE
SpectraBase Compound ID 9kZPA3NaYKq
InChI InChI=1S/C18H24O6/c1-12(9-15(19)22-5)7-8-18(21)13(2)10-14(11-17(18,3)4)24-16(20)23-6/h7-11,21H,1-6H3/b8-7+,12-9-/t18-/m1/s1
InChIKey PAGAAWWKUBMJJT-SYAYYGEISA-N
Mol Weight 336.38 g/mol
Molecular Formula C18H24O6
Exact Mass 336.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6E43aCk0wG
Name (2Z,4E)-5-[(1R)-1-hydroxy-4-methoxycarbonyloxy-2,6,6-trimethyl-1-cyclohexa-2,4-dienyl]-3-methylpenta-2,4-dienoic acid methyl ester
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Formula C18H24O6
InChI InChI=1S/C18H24O6/c1-12(9-15(19)22-5)7-8-18(21)13(2)10-14(11-17(18,3)4)24-16(20)23-6/h7-11,21H,1-6H3/b8-7+,12-9-/t18-/m1/s1
InChIKey PAGAAWWKUBMJJT-SYAYYGEISA-N
Molecular Weight 336.384 g/mol
SMILES O[C@@]1(C(=CC(=CC1(C)C)OC(=O)OC)C)\C=C\C(=C/C(=O)OC)C
SPLASH splash10-003r-9251000000-8ddab9e5859aa269175c
Source of Spectrum KC-0-3063-8
Synonyms (2Z,4E)-5-[(1R)-4-carbomethoxyoxy-1-hydroxy-2,6,6-trimethyl-cyclohexa-2,4-dien-1-yl]-3-methyl-penta-2,4-dienoic acid methyl ester Methyl (2Z,4E)-5-[(1R)-1-hydroxy-4-methoxycarbonyloxy-2,6,6-trimethyl-cyclohexa-2,4-dien-1-yl]-3-methyl-penta-2,4-dienoate Methyl (2Z,4E)-5-[(1R)-4-methoxycarbonyloxy-2,6,6-trimethyl-1-oxidanyl-cyclohexa-2,4-dien-1-yl]-3-methyl-penta-2,4-dienoate
Wiley ID 780387