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4-Butyl-5-(2-phenylethynyl)-1-(2,2,3,3-tetrafluoropropyl)triazole

View entire compound with spectra: 1 MS (GC)

4-Butyl-5-(2-phenylethynyl)-1-(2,2,3,3-tetrafluoropropyl)triazole
SpectraBase Compound ID J5fHUyT8MOl
InChI InChI=1S/C17H17F4N3/c1-2-3-9-14-15(11-10-13-7-5-4-6-8-13)24(23-22-14)12-17(20,21)16(18)19/h4-8,16H,2-3,9,12H2,1H3
InChIKey IYEIQSMFTGFYSF-UHFFFAOYSA-N
Mol Weight 339.34 g/mol
Molecular Formula C17H17F4N3
Exact Mass 339.13586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eKl1geB80L
Name 4-Butyl-5-(2-phenylethynyl)-1-(2,2,3,3-tetrafluoropropyl)triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17F4N3
InChI InChI=1S/C17H17F4N3/c1-2-3-9-14-15(11-10-13-7-5-4-6-8-13)24(23-22-14)12-17(20,21)16(18)19/h4-8,16H,2-3,9,12H2,1H3
InChIKey IYEIQSMFTGFYSF-UHFFFAOYSA-N
Molecular Weight 339.338 g/mol
SMILES c1(nn[n](c1C#Cc1ccccc1)CC(C(F)F)(F)F)CCCC
SPLASH splash10-004i-1923000000-cfcac16c7aca4003efea
Source of Spectrum F4-0-2736-7
Synonyms 4-Butyl-5-(2-phenylethynyl)-1-[2,2,3,3-tetrakis(fluoranyl)propyl]-1,2,3-triazole
Wiley ID 1618793