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1-Ethynyl-4-fluoro-benzene
SpectraBase Compound ID 9530ndioHUy
InChI InChI=1S/C8H5F/c1-2-7-3-5-8(9)6-4-7/h1,3-6H
InChIKey QXSWHQGIEKUBAS-UHFFFAOYSA-N
Mol Weight 120.13 g/mol
Molecular Formula C8H5F
Exact Mass 120.037528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VIzzfi1an5
Name (4-Fluorophenyl)acetylene
Alternate Name(s) 1-Ethynyl-4-fluorobenzene Benzene, 1-ethynyl-4-fluoro- (p-Fluorophenyl)acetylene 1-ethynyl-4-fluoro-benzene 1-ethynyl-4-fluoranyl-benzene 4'-Fluorophenylacetylene 4-FC6H4CCH
CAS Registry Number 766-98-3
Comments Less than 3 mono-isotopic peaks
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Formula C8H5F
InChI InChI=1S/C8H5F/c1-2-7-3-5-8(9)6-4-7/h1,3-6H
InChIKey QXSWHQGIEKUBAS-UHFFFAOYSA-N
Molecular Weight 120.126 g/mol
SMILES C(#C)c1ccc(cc1)F
SPLASH splash10-00b9-9600000000-fe1d173f368cc6120fa8
Source of Spectrum J-58-6618-0
Wiley ID 1127189