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4-(4-bromoquinolin-3-yl)-benzonitrile
SpectraBase Compound ID 3Jc5rOpxXa9
InChI InChI=1S/C16H9BrN2/c17-16-13-3-1-2-4-15(13)19-10-14(16)12-7-5-11(9-18)6-8-12/h1-8,10H
InChIKey YSBWVHYWBJFSCQ-UHFFFAOYSA-N
Mol Weight 309.17 g/mol
Molecular Formula C16H9BrN2
Exact Mass 307.994911 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1HN1eLR7NQ
Name 4-(4-bromoquinolin-3-yl)-benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9BrN2
InChI InChI=1S/C16H9BrN2/c17-16-13-3-1-2-4-15(13)19-10-14(16)12-7-5-11(9-18)6-8-12/h1-8,10H
InChIKey YSBWVHYWBJFSCQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol702494k
Molecular Weight 309.166 g/mol
SMILES c1(c(c2ccccc2nc1)Br)-c1ccc(cc1)C#N
SPLASH splash10-0a6r-0269000000-cdb9250f3981cf0c8188
Source of Spectrum A1-9-5525/SMS9-11i
Synonyms 4-(4-bromoquinolin-3-yl)benzonitrile
Wiley ID 1758884