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1-( 6'-Methylazulen-1'-yl)methyl-3-(6''-methylazulen-1"-yl)ethyl-6-methylazulene
SpectraBase Compound ID JpJ6Bhz1sLk
InChI InChI=1S/C36H32/c1-23-5-11-27-13-14-29(32(27)16-7-23)21-30-22-36(35-19-10-25(3)9-18-34(30)35)26(4)31-20-15-28-12-6-24(2)8-17-33(28)31/h5-20,22,26H,21H2,1-4H3
InChIKey JSCXADQJDCBPOY-UHFFFAOYSA-N
Mol Weight 464.7 g/mol
Molecular Formula C36H32
Exact Mass 464.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qT9yttxaP1
Name 1-( 6'-Methylazulen-1'-yl)methyl-3-(6''-methylazulen-1"-yl)ethyl-6-methylazulene
Alternate Name(s) 6-Methyl-1-[1-(6-methyl-1-azulenyl)ethyl]-3-[(6-methyl-1-azulenyl)methyl]azulene
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Formula C36H32
InChI InChI=1S/C36H32/c1-23-5-11-27-13-14-29(32(27)16-7-23)21-30-22-36(35-19-10-25(3)9-18-34(30)35)26(4)31-20-15-28-12-6-24(2)8-17-33(28)31/h5-20,22,26H,21H2,1-4H3
InChIKey JSCXADQJDCBPOY-UHFFFAOYSA-N
Molecular Weight 464.652 g/mol
SMILES c1(c2c(ccc(cc2)C)c(c1)Cc1c2c(ccc(cc2)C)cc1)C(c1c2c(ccc(cc2)C)cc1)C
SPLASH splash10-0a4i-0419100000-3d24068312e61a860fab
Source of Spectrum U1-1998-430-7
Wiley ID 750882