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4-[3-(Methylamino)propyl]-2-(4-methoxyphenyl)-5-benzoyl-1,3-thiazole hydrobromide
SpectraBase Compound ID 2M79xrUvXmZ
InChI InChI=1S/C21H22N2O2S.BrH/c1-22-14-6-9-18-20(19(24)15-7-4-3-5-8-15)26-21(23-18)16-10-12-17(25-2)13-11-16;/h3-5,7-8,10-13,22H,6,9,14H2,1-2H3;1H
InChIKey UOMOBKPZWPLUGQ-UHFFFAOYSA-N
Mol Weight 447.39 g/mol
Molecular Formula C21H23BrN2O2S
Exact Mass 446.066362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E038zau3Xne
Name 4-[3-(Methylamino)propyl]-2-(4-methoxyphenyl)-5-benzoyl-1,3-thiazole hydrobromide
Alternate Name(s) {3-[5-benzoyl-2-(4-methoxyphenyl)-1,3-thiazol-4-yl]propyl}(methyl)amine hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23BrN2O2S
InChI InChI=1S/C21H22N2O2S.BrH/c1-22-14-6-9-18-20(19(24)15-7-4-3-5-8-15)26-21(23-18)16-10-12-17(25-2)13-11-16;/h3-5,7-8,10-13,22H,6,9,14H2,1-2H3;1H
InChIKey UOMOBKPZWPLUGQ-UHFFFAOYSA-N
Molecular Weight 447.391 g/mol
SMILES Br.N(CCCc1nc(sc1C(c1ccccc1)=O)-c1ccc(cc1)OC)C
SPLASH splash10-0a6u-9503000000-634f8a392ab227b0a70e
Source of Spectrum SO-0-969-5
Wiley ID 1541085