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4-Iodo-3,5-di-p-tolyl-1H-pyrazole
SpectraBase Compound ID GlPbkU5jhFb
InChI InChI=1S/C17H15IN2/c1-11-3-7-13(8-4-11)16-15(18)17(20-19-16)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H,19,20)
InChIKey ADDQCENOXYULPT-UHFFFAOYSA-N
Mol Weight 374.23 g/mol
Molecular Formula C17H15IN2
Exact Mass 374.027993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IB2wpgRDpRl
Name 4-Iodo-3,5-di-p-tolyl-1H-pyrazole
Appearance White solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15IN2
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C17H15IN2/c1-11-3-7-13(8-4-11)16-15(18)17(20-19-16)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H,19,20)
InChIKey ADDQCENOXYULPT-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502995
Molecular Weight 374.225 g/mol
Quality 146
Reported Formula C17H15IN2
SMILES N1C(=C(C(=N1)C1=CC=C(C=C1)C)I)C1=CC=C(C=C1)C
SPLASH splash10-00di-0129000000-0eaa6aad39016e303f90
Source of Spectrum QE-21-SM13-1i (DOI: 10.1002/chem.201502995)
Wiley ID 1907298