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4-[(4-Butylphenyl)ethynyl]-1,2-difluorobenzene
SpectraBase Compound ID I1T2Vz56vWp
InChI InChI=1S/C18H16F2/c1-2-3-4-14-5-7-15(8-6-14)9-10-16-11-12-17(19)18(20)13-16/h5-8,11-13H,2-4H2,1H3
InChIKey OAAKQGAJMFRMHO-UHFFFAOYSA-N
Mol Weight 270.32 g/mol
Molecular Formula C18H16F2
Exact Mass 270.122007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjkE3sWBYFo
Name 4-[(4-Butylphenyl)ethynyl]-1,2-difluorobenzene
Alternate Name(s) 4-[2-(4-butylphenyl)ethynyl]-1,2-bis(fluoranyl)benzene 4-[2-(4-butylphenyl)ethynyl]-1,2-difluoro-benzene Benzene, 4-[(4-butylphenyl)ethynyl]-1,2-difluoro-
CAS Registry Number 109970-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16F2
InChI InChI=1S/C18H16F2/c1-2-3-4-14-5-7-15(8-6-14)9-10-16-11-12-17(19)18(20)13-16/h5-8,11-13H,2-4H2,1H3
InChIKey OAAKQGAJMFRMHO-UHFFFAOYSA-N
Molecular Weight 270.323 g/mol
SMILES c1(F)ccc(cc1F)C#Cc1ccc(cc1)CCCC
SPLASH splash10-004i-1190000000-980cd7111212cebeddf0
Wiley ID 1475842