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2-phenethylisoquinolinium bromide
SpectraBase Compound ID AN4PxlrzR9e
InChI InChI=1S/C17H16N.BrH/c1-2-6-15(7-3-1)10-12-18-13-11-16-8-4-5-9-17(16)14-18;/h1-9,11,13-14H,10,12H2;1H/q+1;/p-1
InChIKey RGEPGGFMNXPUEU-UHFFFAOYSA-M
Mol Weight 314.226 g/mol
Molecular Formula C17H16BrN
Exact Mass 313.046613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIIOyRR9FWp
Name 2-Phenethylisoquinolin-2-ium bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16BrN
InChI InChI=1S/C17H16N.BrH/c1-2-6-15(7-3-1)10-12-18-13-11-16-8-4-5-9-17(16)14-18;/h1-9,11,13-14H,10,12H2;1H/q+1;/p-1
InChIKey RGEPGGFMNXPUEU-UHFFFAOYSA-M
Molecular Weight 314.226 g/mol
SMILES [Br-].C(C[n+]1ccc2ccccc2c1)c1ccccc1
SPLASH splash10-0fb9-6900000000-664fd21d52c7849c6d1b
Source of Spectrum JX-2015-3-57
Synonyms 2-(2-phenylethyl)isoquinolin-2-ium;bromide
Wiley ID 1723659