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4-[4-(Ethylamino)butyl]-2-(4-methoxyphenyl)-5-(4-bromobenzoyl)-1,3-thiazole hydrobromide
SpectraBase Compound ID 2huIIVjg09Z
InChI InChI=1S/C23H25BrN2O2S.BrH/c1-3-25-15-5-4-6-20-22(21(27)16-7-11-18(24)12-8-16)29-23(26-20)17-9-13-19(28-2)14-10-17;/h7-14,25H,3-6,15H2,1-2H3;1H
InChIKey VCRNFDMDAGDDLA-UHFFFAOYSA-N
Mol Weight 554.34 g/mol
Molecular Formula C23H26Br2N2O2S
Exact Mass 552.008175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFFIFaZbQ7A
Name 4-[4-(Ethylamino)butyl]-2-(4-methoxyphenyl)-5-(4-bromobenzoyl)-1,3-thiazole hydrobromide
Alternate Name(s) (4-{5-[(4-bromophenyl)carbonyl]-2-(4-methoxyphenyl)-1,3-thiazol-4-yl}butyl)(ethyl)amine hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26Br2N2O2S
InChI InChI=1S/C23H25BrN2O2S.BrH/c1-3-25-15-5-4-6-20-22(21(27)16-7-11-18(24)12-8-16)29-23(26-20)17-9-13-19(28-2)14-10-17;/h7-14,25H,3-6,15H2,1-2H3;1H
InChIKey VCRNFDMDAGDDLA-UHFFFAOYSA-N
Molecular Weight 554.341 g/mol
SMILES Br.N(CCCCc1nc(sc1C(c1ccc(cc1)Br)=O)-c1ccc(cc1)OC)CC
SPLASH splash10-0a4i-9410000000-f31a0aaac29f12b35801
Source of Spectrum SO-0-969-5
Wiley ID 1541081