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2-Amino-5-(4-nitrophenyl)-4-[3-(pyrrolodin-2-ylidene)aminopropyl]thiazole hydrobromide
SpectraBase Compound ID WkkeQbido6
InChI InChI=1S/C16H19N5O2S.BrH/c17-16-20-13(3-1-9-18-14-4-2-10-19-14)15(24-16)11-5-7-12(8-6-11)21(22)23;/h5-8H,1-4,9-10H2,(H2,17,20)(H,18,19);1H
InChIKey YPWNMYZOLVMXOW-UHFFFAOYSA-N
Mol Weight 426.33 g/mol
Molecular Formula C16H20BrN5O2S
Exact Mass 425.052109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBTFv81FbCW
Name 2-Amino-5-(4-nitrophenyl)-4-[3-(pyrrolodin-2-ylidene)aminopropyl]thiazole hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20BrN5O2S
InChI InChI=1S/C16H19N5O2S.BrH/c17-16-20-13(3-1-9-18-14-4-2-10-19-14)15(24-16)11-5-7-12(8-6-11)21(22)23;/h5-8H,1-4,9-10H2,(H2,17,20)(H,18,19);1H
InChIKey YPWNMYZOLVMXOW-UHFFFAOYSA-N
Molecular Weight 426.333 g/mol
SMILES Br.N1CCC\C1=N/CCCc1nc(sc1-c1ccc(N(=O)=O)cc1)N
SPLASH splash10-0002-9000000000-7aa8971463a9768fd0b7
Source of Spectrum SO-0-675-8
Wiley ID 1543417