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1-[(4-methoxyphenyl)(3-methyl-1-azulenyl)methyl]-3-methylazulene
SpectraBase Compound ID 4s9xWpYhnsc
InChI InChI=1S/C30H26O/c1-20-18-28(26-12-8-4-6-10-24(20)26)30(22-14-16-23(31-3)17-15-22)29-19-21(2)25-11-7-5-9-13-27(25)29/h4-19,30H,1-3H3
InChIKey DXSGHFLMOQUOED-UHFFFAOYSA-N
Mol Weight 402.54 g/mol
Molecular Formula C30H26O
Exact Mass 402.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1AXYbzamAH
Name 1-[(4-methoxyphenyl)(3-methyl-1-azulenyl)methyl]-3-methylazulene
Alternate Name(s) 4-[bis(3-methyl-1-azulenyl)methyl]phenyl methyl ether Bis(3-methyl-1-azulenyl)(4-methoxyphenyl))methane
Comments Less than 3 mono-isotopic peaks
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Formula C30H26O
InChI InChI=1S/C30H26O/c1-20-18-28(26-12-8-4-6-10-24(20)26)30(22-14-16-23(31-3)17-15-22)29-19-21(2)25-11-7-5-9-13-27(25)29/h4-19,30H,1-3H3
InChIKey DXSGHFLMOQUOED-UHFFFAOYSA-N
Molecular Weight 402.537 g/mol
SMILES c1(c2c(ccccc2)c(c1)C)C(c1c2c(ccccc2)c(c1)C)c1ccc(cc1)OC
SPLASH splash10-0udi-0002900000-55542d0e2b98eff0d30b
Source of Spectrum AJ-72-844-14
Wiley ID 774955