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Isoquinolinium, 2-methyl-1-phenyl-, iodide

View entire compound with spectra: 1 MS (GC)

Isoquinolinium, 2-methyl-1-phenyl-, iodide
SpectraBase Compound ID B5u69UdAiWQ
InChI InChI=1S/C16H14N.HI/c1-17-12-11-13-7-5-6-10-15(13)16(17)14-8-3-2-4-9-14;/h2-12H,1H3;1H/q+1;/p-1
InChIKey BTQJXFRTYSABQQ-UHFFFAOYSA-M
Mol Weight 347.2 g/mol
Molecular Formula C16H14IN
Exact Mass 347.017094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmSC7RVzTU1
Name Isoquinolinium, 2-methyl-1-phenyl-, iodide
CAS Registry Number 52806-07-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14IN
InChI InChI=1S/C16H14N.HI/c1-17-12-11-13-7-5-6-10-15(13)16(17)14-8-3-2-4-9-14;/h2-12H,1H3;1H/q+1;/p-1
InChIKey BTQJXFRTYSABQQ-UHFFFAOYSA-M
Molecular Weight 347.199 g/mol
SMILES [I-].c1([n+](ccc2ccccc12)C)-c1ccccc1
SPLASH splash10-0udi-1190000000-fb65953423adf4c24e55
Source of Spectrum O-8-362-16
Synonyms 2-Methyl-1-phenylisoquinolinium iodide
Wiley ID 1339918