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2-Ethylamino-5-(4-nitrophenyl)-4-[6-(1-azacyclooct-2-ylidene)aminohexyl]thiazole hydrobromide
SpectraBase Compound ID 4EcXFbR3EM2
InChI InChI=1S/C24H35N5O2S.BrH/c1-2-25-24-28-21(23(32-24)19-13-15-20(16-14-19)29(30)31)11-7-3-5-9-17-26-22-12-8-4-6-10-18-27-22;/h13-16H,2-12,17-18H2,1H3,(H,25,28)(H,26,27);1H
InChIKey ULBUITPIZKLGHJ-UHFFFAOYSA-N
Mol Weight 538.5 g/mol
Molecular Formula C24H36BrN5O2S
Exact Mass 537.17731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3s1H6Q7yGBK
Name 2-Ethylamino-5-(4-nitrophenyl)-4-[6-(1-azacyclooct-2-ylidene)aminohexyl]thiazole hydrobromide
Alternate Name(s) 4-{6-[(2Z)-azocan-2-ylideneamino]hexyl}-N-ethyl-5-(4-nitrophenyl)-1,3-thiazol-2-amine hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36BrN5O2S
InChI InChI=1S/C24H35N5O2S.BrH/c1-2-25-24-28-21(23(32-24)19-13-15-20(16-14-19)29(30)31)11-7-3-5-9-17-26-22-12-8-4-6-10-18-27-22;/h13-16H,2-12,17-18H2,1H3,(H,25,28)(H,26,27);1H
InChIKey ULBUITPIZKLGHJ-UHFFFAOYSA-N
Molecular Weight 538.549 g/mol
SMILES Br.N1CCCCCC\C1=N/CCCCCCc1c(sc(n1)NCC)-c1ccc(cc1)N(=O)=O
SPLASH splash10-01q9-9300000000-35f54c8c0f7c07c8bd1d
Source of Spectrum SO-0-676-8
Wiley ID 1543405