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2-(5-(4-(Trifluoromethyl)phenyl)-2H-1,2,3-triazol-4-yl)benzonitrile
SpectraBase Compound ID F145MnFLuiw
InChI InChI=1S/C16H9F3N4/c17-16(18,19)12-7-5-10(6-8-12)14-15(22-23-21-14)13-4-2-1-3-11(13)9-20/h1-8H,(H,21,22,23)
InChIKey QUAWTIMEVWPNOD-UHFFFAOYSA-N
Mol Weight 314.27 g/mol
Molecular Formula C16H9F3N4
Exact Mass 314.077931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQeGPhQ96wR
Name 2-(5-(4-(Trifluoromethyl)phenyl)-2H-1,2,3-triazol-4-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9F3N4
InChI InChI=1S/C16H9F3N4/c17-16(18,19)12-7-5-10(6-8-12)14-15(22-23-21-14)13-4-2-1-3-11(13)9-20/h1-8H,(H,21,22,23)
InChIKey QUAWTIMEVWPNOD-UHFFFAOYSA-N
Molecular Weight 314.271 g/mol
SMILES [nH]1nc(c(n1)-c1c(C#N)cccc1)-c1ccc(C(F)(F)F)cc1
SPLASH splash10-03di-0249000000-3c77ecbc634bcde5cf13
Source of Spectrum F-65-8370-6b
Synonyms 2-[5-[4-(trifluoromethyl)phenyl]-2H-1,2,3-triazol-4-yl]benzenecarbonitrile
Wiley ID 1679512