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1-(3,5-Di-sec-butylphenyl)-3,5-dimethyl-1H-pyrazole
SpectraBase Compound ID CTEUbnLaMEB
InChI InChI=1S/C19H28N2/c1-7-13(3)17-10-18(14(4)8-2)12-19(11-17)21-16(6)9-15(5)20-21/h9-14H,7-8H2,1-6H3
InChIKey YPVMNIZWEPLIRU-UHFFFAOYSA-N
Mol Weight 284.45 g/mol
Molecular Formula C19H28N2
Exact Mass 284.225249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mU39UxHaMl
Name 1-(3,5-Di-sec-butylphenyl)-3,5-dimethyl-1H-pyrazole
Appearance Colorless oil
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Formula C19H28N2
InChI InChI=1S/C19H28N2/c1-7-13(3)17-10-18(14(4)8-2)12-19(11-17)21-16(6)9-15(5)20-21/h9-14H,7-8H2,1-6H3
InChIKey YPVMNIZWEPLIRU-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.202007144
Molecular Weight 284.447 g/mol
Reported Formula C19H28N2
SMILES c1c(cc(cc1C(CC)C)C(CC)C)-[n]1c(cc(n1)C)C
SPLASH splash10-0a59-0190000000-be456cab45e1cca0e8c9
Sample Comments diastereomeric mixture (1:1)
Source of Spectrum ACI-59-SM25-7gg'
Wiley ID 1858339