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3-[(3-tert-butyl-1-azulenyl)-(3-methyl-1-azulenyl)methyl]-1-azulenecarboxylic acid methyl ester
SpectraBase Compound ID CYXxWpou4So
InChI InChI=1S/C38H34O2/c1-24-21-31(26-16-10-6-9-15-25(24)26)36(32-22-34(37(39)40-5)28-18-12-7-11-17-27(28)32)33-23-35(38(2,3)4)30-20-14-8-13-19-29(30)33/h6-23,36H,1-5H3
InChIKey FKTUGAYQJSKXTG-UHFFFAOYSA-N
Mol Weight 522.7 g/mol
Molecular Formula C38H34O2
Exact Mass 522.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71k1adGD24I
Name 3-[(3-tert-butyl-1-azulenyl)-(3-methyl-1-azulenyl)methyl]-1-azulenecarboxylic acid methyl ester
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Formula C38H34O2
InChI InChI=1S/C38H34O2/c1-24-21-31(26-16-10-6-9-15-25(24)26)36(32-22-34(37(39)40-5)28-18-12-7-11-17-27(28)32)33-23-35(38(2,3)4)30-20-14-8-13-19-29(30)33/h6-23,36H,1-5H3
InChIKey FKTUGAYQJSKXTG-UHFFFAOYSA-N
Molecular Weight 522.688 g/mol
SMILES c1(C(c2c3c(ccccc3)c(c2)C(=O)OC)c2c3c(ccccc3)c(c2)C)c2c(ccccc2)c(c1)C(C)(C)C
SPLASH splash10-00di-0000290000-4dba08e66371cacfcc1f
Source of Spectrum AJ-68-2014-7
Synonyms 3-[(3-tert-butylazulen-1-yl)-(3-methylazulen-1-yl)methyl]azulene-1-carboxylic acid methyl ester Methyl 3-[(3-tert-butylazulen-1-yl)-(3-methylazulen-1-yl)methyl]azulene-1-carboxylate
Wiley ID 773431