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5-phenyl-1-(2,4,6-trimethylphenyl)pyrazole
SpectraBase Compound ID A3fGsDImqbl
InChI InChI=1S/C18H18N2/c1-13-11-14(2)18(15(3)12-13)20-17(9-10-19-20)16-7-5-4-6-8-16/h4-12H,1-3H3
InChIKey FPHIKIBWZUSJQV-UHFFFAOYSA-N
Mol Weight 262.36 g/mol
Molecular Formula C18H18N2
Exact Mass 262.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DaGrrdZBhAa
Name 5-phenyl-1-(2,4,6-trimethylphenyl)pyrazole
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.146998588 u
Formula C18H18N2
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C18H18N2/c1-13-11-14(2)18(15(3)12-13)20-17(9-10-19-20)16-7-5-4-6-8-16/h4-12H,1-3H3
InChIKey FPHIKIBWZUSJQV-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502995
Molecular Weight 262.356 g/mol
Quality 921
SMILES C1=NN(C(=C1)C1=CC=CC=C1)C1=C(C=C(C=C1C)C)C
SPLASH splash10-03dj-2690000000-2c4fb3374b656ec44a63
Source of Spectrum QE-21-SM6-3 (DOI: 10.1002/chem.201502995)
Wiley ID 1907323