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1-benzhydryl-6-tert-butyl-azulene
SpectraBase Compound ID C7jwZA04kRG
InChI InChI=1S/C27H26/c1-27(2,3)23-16-14-20-15-18-25(24(20)19-17-23)26(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-19,26H,1-3H3
InChIKey KBHBNVGYRMDSIW-UHFFFAOYSA-N
Mol Weight 350.51 g/mol
Molecular Formula C27H26
Exact Mass 350.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECRKVEFyfsV
Name 1-benzhydryl-6-tert-butyl-azulene
Comments Less than 3 mono-isotopic peaks
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Formula C27H26
InChI InChI=1S/C27H26/c1-27(2,3)23-16-14-20-15-18-25(24(20)19-17-23)26(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-19,26H,1-3H3
InChIKey KBHBNVGYRMDSIW-UHFFFAOYSA-N
Molecular Weight 350.505 g/mol
SMILES c1(c2ccc(C(C)(C)C)ccc2cc1)C(c1ccccc1)c1ccccc1
SPLASH splash10-0udi-0029000000-b1e6c40c99413fec2611
Source of Spectrum AJ-68-1432-11
Synonyms 6-tert-butyl-1-(diphenylmethyl)azulene
Wiley ID 773280