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Methyl 6-(2',6'-dimethoxy-4'-pentylphenyl)-4-methylcyclohexa-1,4-diene-1-carboxylate
SpectraBase Compound ID G3tO8LNkltp
InChI InChI=1S/C22H30O4/c1-6-7-8-9-16-13-19(24-3)21(20(14-16)25-4)18-12-15(2)10-11-17(18)22(23)26-5/h11-14,18H,6-10H2,1-5H3
InChIKey BHTLOGIQMRPVGE-UHFFFAOYSA-N
Mol Weight 358.48 g/mol
Molecular Formula C22H30O4
Exact Mass 358.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qHXh7FkU8L
Name Methyl 6-(2',6'-dimethoxy-4'-pentylphenyl)-4-methylcyclohexa-1,4-diene-1-carboxylate
Alternate Name(s) Methyl 2',6'-dimethoxy-5-methyl-4'-pentyl-1,4-dihydro-[1,1'-biphenyl]-2-carboxylate 6-(2,6-dimethoxy-4-pentylphenyl)-4-methyl-1-cyclohexa-1,4-dienecarboxylic acid methyl ester Methyl 6-(2,6-dimethoxy-4-pentylphenyl)-4-methylcyclohexa-1,4-diene-1-carboxylate Methyl 6-(2,6-dimethoxy-4-pentyl-phenyl)-4-methyl-cyclohexa-1,4-diene-1-carboxylate
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Formula C22H30O4
InChI InChI=1S/C22H30O4/c1-6-7-8-9-16-13-19(24-3)21(20(14-16)25-4)18-12-15(2)10-11-17(18)22(23)26-5/h11-14,18H,6-10H2,1-5H3
InChIKey BHTLOGIQMRPVGE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301203k
Molecular Weight 358.478 g/mol
SMILES c1c(OC)c(C2C(C(=O)OC)=CCC(C)=C2)c(cc1CCCCC)OC
SPLASH splash10-004j-0597000000-237ddb32fda149ea41b7
Source of Spectrum J-77-7929-6d
Wiley ID 1746993