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1-Hydroxy-2-(2-(2,2,2-trifluoroethyl)pyrazol-3-yl)[2.2]-paracyclophane
SpectraBase Compound ID 19cXmWGwHc5
InChI InChI=1S/C21H19F3N2O/c22-21(23,24)13-26-18(11-12-25-26)19-16-7-5-14-1-3-15(4-2-14)6-8-17(10-9-16)20(19)27/h1-4,9-12,27H,5-8,13H2
InChIKey REDXPIKBXOOKPH-UHFFFAOYSA-N
Mol Weight 372.39 g/mol
Molecular Formula C21H19F3N2O
Exact Mass 372.144948 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EkxMhFkkRbs
Name 1-Hydroxy-2-(2-(2,2,2-trifluoroethyl)pyrazol-3-yl)[2.2]-paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19F3N2O
InChI InChI=1S/C21H19F3N2O/c22-21(23,24)13-26-18(11-12-25-26)19-16-7-5-14-1-3-15(4-2-14)6-8-17(10-9-16)20(19)27/h1-4,9-12,27H,5-8,13H2
InChIKey REDXPIKBXOOKPH-UHFFFAOYSA-N
Molecular Weight 372.391 g/mol
SMILES Oc1c(-c2[n](CC(F)(F)F)ncc2)c2ccc1CCc1ccc(CC2)cc1
SPLASH splash10-0v4i-0976000000-29a1380ddd2334082254
Source of Spectrum U1-2013-6117-12c
Wiley ID 1740392