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1-bromanyl-6-(2-ethynylphenyl)hex-5-yn-3-ol
SpectraBase Compound ID 5RRFQ4Pl2kx
InChI InChI=1S/C14H13BrO/c1-2-12-6-3-4-7-13(12)8-5-9-14(16)10-11-15/h1,3-4,6-7,14,16H,9-11H2
InChIKey PNHFTFFRAKNQJA-UHFFFAOYSA-N
Mol Weight 277.16 g/mol
Molecular Formula C14H13BrO
Exact Mass 276.014978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ib0vOTaEn6c
Name 1-bromanyl-6-(2-ethynylphenyl)hex-5-yn-3-ol
Alternate Name(s) 1-bromo-6-(2-ethynylphenyl)-5-hexyn-3-ol 1-bromo-6-(2-ethynylphenyl)hex-5-yn-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C14H13BrO
InChI InChI=1S/C14H13BrO/c1-2-12-6-3-4-7-13(12)8-5-9-14(16)10-11-15/h1,3-4,6-7,14,16H,9-11H2
InChIKey PNHFTFFRAKNQJA-UHFFFAOYSA-N
Molecular Weight 277.161 g/mol
SMILES OC(CCBr)CC#Cc1c(C#C)cccc1
SPLASH splash10-0006-0900000000-d7733908835773a8852d
Source of Spectrum J-59-5044-31
Wiley ID 1279864