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1-Benzyl-4-(1-phenylvinyl)-1H-pyrazole
SpectraBase Compound ID DeauLffyYsx
InChI InChI=1S/C18H16N2/c1-15(17-10-6-3-7-11-17)18-12-19-20(14-18)13-16-8-4-2-5-9-16/h2-12,14H,1,13H2
InChIKey SYXSBFPBISUJFC-UHFFFAOYSA-N
Mol Weight 260.34 g/mol
Molecular Formula C18H16N2
Exact Mass 260.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fi4qQrVHDG
Name 1-Benzyl-4-(1-phenylvinyl)-1H-pyrazole
Appearance Light yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2
InChI InChI=1S/C18H16N2/c1-15(17-10-6-3-7-11-17)18-12-19-20(14-18)13-16-8-4-2-5-9-16/h2-12,14H,1,13H2
InChIKey SYXSBFPBISUJFC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI pos
Literature Reference DOI 10.1002/anie.201810327
Molecular Weight 260.340 g/mol
Reported Formula C18H16N2
SMILES c1(C(=C)c2ccccc2)cn[n](c1)Cc1ccccc1
SPLASH splash10-01ox-7290000000-e8c3131bc210317e6335
Source of Spectrum ACI-58-SM37-10l
Thin-Layer Chromatography Rf = 0.28 (hexane/EtOAc 90:10, UV, KMnO4, PAA)
Wiley ID 1840490