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4,6,8-Trimethylazulene
SpectraBase Compound ID 6VSkiKqJU1N
InChI InChI=1S/C13H14/c1-9-7-10(2)12-5-4-6-13(12)11(3)8-9/h4-8H,1-3H3
InChIKey RUNBRXWUHPOTOO-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C13H14
Exact Mass 170.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3juntpjLQ9u
Name 4,6,8-Trimethylazulene
CAS Registry Number 941-81-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14
InChI InChI=1S/C13H14/c1-9-7-10(2)12-5-4-6-13(12)11(3)8-9/h4-8H,1-3H3
InChIKey RUNBRXWUHPOTOO-UHFFFAOYSA-N
Molecular Weight 170.255 g/mol
SMILES Cc1cc(C)c2cccc2c(c1)C
SPLASH splash10-05fr-2900000000-a342dfaf79342a4f63c8
Source of Spectrum HE-1982-0-0
Synonyms 2,4,6-Trimethylbicyclo(5.3.0)deca-2,4,6,8,10-pentaene Azulene, 4,6,8-trimethyl- EINECS 213-383-6
Wiley ID 1167638