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2-Benzoyl-N-(4-methylphenyl)thieno[2,3-b]pyridinium Bromide

View entire compound with spectra: 1 MS (GC)

2-Benzoyl-N-(4-methylphenyl)thieno[2,3-b]pyridinium Bromide
SpectraBase Compound ID 5286clZZxyB
InChI InChI=1S/C21H16NOS.BrH/c1-15-9-11-18(12-10-15)22-13-5-8-17-14-19(24-21(17)22)20(23)16-6-3-2-4-7-16;/h2-14H,1H3;1H/q+1;/p-1
InChIKey IUYLUBUYKNSSGR-UHFFFAOYSA-M
Mol Weight 410.33 g/mol
Molecular Formula C21H16BrNOS
Exact Mass 409.013598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbFdX3OrDVP
Name 2-Benzoyl-N-(4-methylphenyl)thieno[2,3-b]pyridinium Bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16BrNOS
InChI InChI=1S/C21H16NOS.BrH/c1-15-9-11-18(12-10-15)22-13-5-8-17-14-19(24-21(17)22)20(23)16-6-3-2-4-7-16;/h2-14H,1H3;1H/q+1;/p-1
InChIKey IUYLUBUYKNSSGR-UHFFFAOYSA-M
Molecular Weight 410.329 g/mol
SMILES [Br-].c12[n+](-c3ccc(C)cc3)cccc2cc(s1)C(=O)c1ccccc1
SPLASH splash10-001i-1009000000-9480e221bd9e414b1e56
Source of Spectrum SO-0-343-3
Synonyms 2-Benzoyl-7-(4-methylphenyl)thieno[2,3-b]pyridin-7-ium bromide 6-Benzoyl-N-(4-methylphenyl)thieno[2,3-b]pyridinium Bromide
Wiley ID 1538844