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4-(1-Benzyl-1H-4-pyrazolyl)-2-butanone

View entire compound with spectra: 1 MS (GC)

4-(1-Benzyl-1H-4-pyrazolyl)-2-butanone
SpectraBase Compound ID 7F6VRxL0mM6
InChI InChI=1S/C14H16N2O/c1-12(17)7-8-14-9-15-16(11-14)10-13-5-3-2-4-6-13/h2-6,9,11H,7-8,10H2,1H3
InChIKey LPLFFTGPBOIJFI-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C14H16N2O
Exact Mass 228.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JeQH0kPgmy
Name 4-(1-Benzyl-1H-4-pyrazolyl)-2-butanone
Alternate Name(s) 4-(1-benzyl-1H-pyrazol-4-yl)-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O
InChI InChI=1S/C14H16N2O/c1-12(17)7-8-14-9-15-16(11-14)10-13-5-3-2-4-6-13/h2-6,9,11H,7-8,10H2,1H3
InChIKey LPLFFTGPBOIJFI-UHFFFAOYSA-N
Molecular Weight 228.295 g/mol
SMILES c1n[n](cc1CCC(=O)C)Cc1ccccc1
SPLASH splash10-0a4i-3910000000-7e81b706c2b8fc0da625
Source of Spectrum QB-22-646-7
Wiley ID 860634