For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(4-Methoxybenzoyl)-3,6-diphenyl-2,3-dihydro-4H-thiazolo[2,3-b][1,3,4]thiadiazin-5-ium bromide
SpectraBase Compound ID GBhsHE4U8bK
InChI InChI=1S/C25H21N2O2S2.BrH/c1-29-20-14-12-19(13-15-20)23(28)24-22(18-10-6-3-7-11-18)26-27-21(16-30-25(27)31-24)17-8-4-2-5-9-17;/h2-16,22,24,26H,1H3;1H/q+1;/p-1
InChIKey VYUQUOORAFVDDZ-UHFFFAOYSA-M
Mol Weight 525.48 g/mol
Molecular Formula C25H21BrN2O2S2
Exact Mass 524.022783 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Lbu83kaAvQg
Name 2-(4-Methoxybenzoyl)-3,6-diphenyl-2,3-dihydro-4H-thiazolo[2,3-b][1,3,4]thiadiazin-5-ium bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21BrN2O2S2
InChI InChI=1S/C25H21N2O2S2.BrH/c1-29-20-14-12-19(13-15-20)23(28)24-22(18-10-6-3-7-11-18)26-27-21(16-30-25(27)31-24)17-8-4-2-5-9-17;/h2-16,22,24,26H,1H3;1H/q+1;/p-1
InChIKey VYUQUOORAFVDDZ-UHFFFAOYSA-M
Molecular Weight 525.479 g/mol
SMILES [Br-].N1C(C(Sc2[n+]1c(cs2)-c1ccccc1)C(c1ccc(OC)cc1)=O)c1ccccc1
SPLASH splash10-000i-0900000000-1bce3bafd0c1759eba68
Source of Spectrum SO-0-731-7
Synonyms 7-(4-Methoxybenzoyl)-3,6-diphenyl-6,7-dihydro-5H-[1,3]thiazolo[2,3-b][1,3,4]thiadiazin-4-ium bromide
Wiley ID 1540138