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3-(p-Cyanophenyl)-5-(2'-phenylethyl)-pyrazol-4-one - Oxime - 1,2-dioxide
SpectraBase Compound ID Jd1zCU240Q4
InChI InChI=1S/C18H14N4O3/c19-12-14-6-9-15(10-7-14)18-17(20-23)16(21(24)22(18)25)11-8-13-4-2-1-3-5-13/h1-7,9-10,23H,8,11H2/b20-17+
InChIKey DXJKKVKZWNNUJX-LVZFUZTISA-N
Mol Weight 334.34 g/mol
Molecular Formula C18H14N4O3
Exact Mass 334.10659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6trKxLYTww
Name 3-(p-Cyanophenyl)-5-(2'-phenylethyl)-pyrazol-4-one - Oxime - 1,2-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N4O3
InChI InChI=1S/C18H14N4O3/c19-12-14-6-9-15(10-7-14)18-17(20-23)16(21(24)22(18)25)11-8-13-4-2-1-3-5-13/h1-7,9-10,23H,8,11H2/b20-17+
InChIKey DXJKKVKZWNNUJX-LVZFUZTISA-N
Molecular Weight 334.335 g/mol
SMILES O\N=C\1C(=[N+]([N+](=C1CCc1ccccc1)[O-])[O-])c1ccc(C#N)cc1
SPLASH splash10-002f-9800000000-0a879437b9afafbf01d4
Source of Spectrum D8-328-768-28
Wiley ID 1516019