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1,7-Dimethyl-4-[2'-phenylethenyl]-azulene
SpectraBase Compound ID 4eXLqWuqNN5
InChI InChI=1S/C20H18/c1-15-8-11-18(12-10-17-6-4-3-5-7-17)19-13-9-16(2)20(19)14-15/h3-14H,1-2H3/b12-10+
InChIKey VEZJHUUGLGVIKP-ZRDIBKRKSA-N
Mol Weight 258.36 g/mol
Molecular Formula C20H18
Exact Mass 258.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID izo26TsbBu
Name 1,7-Dimethyl-4-[2'-phenylethenyl]-azulene
Comments Less than 3 mono-isotopic peaks
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Formula C20H18
InChI InChI=1S/C20H18/c1-15-8-11-18(12-10-17-6-4-3-5-7-17)19-13-9-16(2)20(19)14-15/h3-14H,1-2H3/b12-10+
InChIKey VEZJHUUGLGVIKP-ZRDIBKRKSA-N
Molecular Weight 258.364 g/mol
SMILES c12c(ccc2C)c(\C=C\c2ccccc2)ccc(c1)C
SPLASH splash10-0a4l-0090000000-03f2ad2691ac490fb691
Source of Spectrum H-82-312-4
Synonyms 1,7-dimethyl-4-[(E)-2-phenylethenyl]azulene
Wiley ID 815370