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Benzeneethanol, .alpha.-methyl-2-(1-propynyl)-
SpectraBase Compound ID 55HTTboJP0O
InChI InChI=1S/C12H14O/c1-3-6-11-7-4-5-8-12(11)9-10(2)13/h4-5,7-8,10,13H,9H2,1-2H3
InChIKey OPUINNAMMRSPDM-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKq87jRlGXd
Name Benzeneethanol, .alpha.-methyl-2-(1-propynyl)-
CAS Registry Number 93769-01-8
Comments Less than 3 mono-isotopic peaks
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Formula C12H14O
InChI InChI=1S/C12H14O/c1-3-6-11-7-4-5-8-12(11)9-10(2)13/h4-5,7-8,10,13H,9H2,1-2H3
InChIKey OPUINNAMMRSPDM-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES OC(Cc1c(C#CC)cccc1)C
SPLASH splash10-001i-0900000000-4e9ed5e394b75542626b
Source of Spectrum K-117-3030-0
Synonyms 1-[2-(1-propyne-1-yl)phenyl]-2-propanol 1-[2-(1-propynyl)phenyl]-2-propanol
Wiley ID 1170970