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1-[3-(tert-Butyl)-4-fluorophenyl]-1H-pyrazole
SpectraBase Compound ID Iy2Q8CMPCI8
InChI InChI=1S/C13H15FN2/c1-13(2,3)11-9-10(5-6-12(11)14)16-8-4-7-15-16/h4-9H,1-3H3
InChIKey RFWSRPXRQCMUPX-UHFFFAOYSA-N
Mol Weight 218.28 g/mol
Molecular Formula C13H15FN2
Exact Mass 218.121927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID XCT4eW7hMZ
Name 1-[3-(tert-Butyl)-4-fluorophenyl]-1H-pyrazole
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15FN2
InChI InChI=1S/C13H15FN2/c1-13(2,3)11-9-10(5-6-12(11)14)16-8-4-7-15-16/h4-9H,1-3H3
InChIKey RFWSRPXRQCMUPX-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.202007144
Molecular Weight 218.275 g/mol
Reported Formula C13H15FN2
SMILES c1c(cc(c(c1)F)C(C)(C)C)-[n]1cccn1
SPLASH splash10-0v00-0390000000-23608b04379067760739
Source of Spectrum ACI-59-SM38-7dr
Wiley ID 1858333