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2-(1,1-Dimethyl-2-propenyl)-3,6-dimethylphenol
SpectraBase Compound ID FFlD5D8lsNY
InChI InChI=1S/C13H18O/c1-6-13(4,5)11-9(2)7-8-10(3)12(11)14/h6-8,14H,1H2,2-5H3
InChIKey ZGIZMIZAICFCIU-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0by1c2OyKw
Name 2-(1,1-Dimethyl-2-propenyl)-3,6-dimethylphenol
CAS Registry Number 35602-82-5
Comments Note: The molecular formula of the structure shown is C13H18O - which differs from the formula reported for the mass spectrum (C13H17DO)
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Formula C13H17DO
InChI InChI=1S/C13H18O/c1-6-13(4,5)11-9(2)7-8-10(3)12(11)14/h6-8,14H,1H2,2-5H3
InChIKey ZGIZMIZAICFCIU-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES Oc1c(c(C)ccc1C)C(C)(C)C=C
SPLASH splash10-004i-3900000000-a87a109f289c3d80390c
Synonyms 2-(1,1-dimethylallyl)-3,6-dimethyl-phenol 3,6-Dimethyl-2-(2-methylbut-3-en-2-yl)phenol Phenol, 2-(1,1-dimethyl-2-propenyl)-3,6-dimethyl-
Wiley ID 1485705