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4-(4-iodo-6-phenyl-1,3,5-triazin-2-yl)benzonitrile

View entire compound with spectra: 1 MS (GC)

4-(4-iodo-6-phenyl-1,3,5-triazin-2-yl)benzonitrile
SpectraBase Compound ID 6BH0mVmc5y7
InChI InChI=1S/C16H9IN4/c17-16-20-14(12-4-2-1-3-5-12)19-15(21-16)13-8-6-11(10-18)7-9-13/h1-9H
InChIKey WSKFEEZGWJMAQR-UHFFFAOYSA-N
Mol Weight 384.18 g/mol
Molecular Formula C16H9IN4
Exact Mass 383.987191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eui0OZQMN0F
Name 4-(4-iodo-6-phenyl-1,3,5-triazin-2-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9IN4
InChI InChI=1S/C16H9IN4/c17-16-20-14(12-4-2-1-3-5-12)19-15(21-16)13-8-6-11(10-18)7-9-13/h1-9H
InChIKey WSKFEEZGWJMAQR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol102173z
Molecular Weight 384.180 g/mol
SMILES c1(nc(I)nc(-c2ccc(cc2)C#N)n1)-c1ccccc1
SPLASH splash10-0fb9-0920000000-10102dde8dc353ba3362
Source of Spectrum A1-12-5398/SMS11-1j
Wiley ID 1752650