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3,3,3-Trifluoro-1-(pyridin-4-yl)prop-1-en-2-ol
SpectraBase Compound ID 9WXff97Rv3H
InChI InChI=1S/C8H6F3NO/c9-8(10,11)7(13)5-6-1-3-12-4-2-6/h1-5,13H
InChIKey YUOUSPDBGGMSML-UHFFFAOYSA-N
Mol Weight 189.14 g/mol
Molecular Formula C8H6F3NO
Exact Mass 189.040148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsbNNmZN268
Name 3,3,3-Trifluoro-1-(pyridin-4-yl)prop-1-en-2-ol
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F3NO
InChI InChI=1S/C8H6F3NO/c9-8(10,11)7(13)5-6-1-3-12-4-2-6/h1-5,13H
InChIKey YUOUSPDBGGMSML-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95 XP
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202100392
Molecular Weight 189.137 g/mol
Reported Formula C8H6F3NO
SMILES OC(C(F)(F)F)=Cc1ccncc1
SPLASH splash10-000f-9200000000-ddfcf7ca3fcd47b3a79a
Source of Spectrum CBC-22-SM3-2d
Wiley ID 1865327