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Bis(3,6-di-t-butyl-1-azulenyl)[4-(dimethylamino)phenyl]methane
SpectraBase Compound ID JWgAkJfdqpN
InChI InChI=1S/C45H57N/c1-42(2,3)30-17-23-33-35(25-19-30)39(44(7,8)9)27-37(33)41(29-15-21-32(22-16-29)46(13)14)38-28-40(45(10,11)12)36-26-20-31(43(4,5)6)18-24-34(36)38/h15-28,41H,1-14H3
InChIKey CFADJZBVSZVXOC-UHFFFAOYSA-N
Mol Weight 612.0 g/mol
Molecular Formula C45H57N
Exact Mass 611.449101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GArJpnuuWDL
Name Bis(3,6-di-t-butyl-1-azulenyl)[4-(dimethylamino)phenyl]methane
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Formula C45H57N
InChI InChI=1S/C45H57N/c1-42(2,3)30-17-23-33-35(25-19-30)39(44(7,8)9)27-37(33)41(29-15-21-32(22-16-29)46(13)14)38-28-40(45(10,11)12)36-26-20-31(43(4,5)6)18-24-34(36)38/h15-28,41H,1-14H3
InChIKey CFADJZBVSZVXOC-UHFFFAOYSA-N
Molecular Weight 611.958 g/mol
SMILES c1(c2c(ccc(cc2)C(C)(C)C)c(c1)C(C)(C)C)C(c1c2c(ccc(cc2)C(C)(C)C)c(c1)C(C)(C)C)c1ccc(cc1)N(C)C
SPLASH splash10-0r00-4011096000-1b6dc6880831acd54041
Source of Spectrum AJ-69-3232-7
Synonyms 4-[bis(3,6-ditert-butyl-1-azulenyl)methyl]-N,N-dimethylaniline 4-[bis(3,6-ditert-butylazulen-1-yl)methyl]-N,N-dimethyl-aniline N-{4-[bis(3,6-ditert-butyl-1-azulenyl)methyl]phenyl}-N,N-dimethylamine [4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenyl]-dimethyl-amine
Wiley ID 773919