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3-(3-Dimethylamoniumpropyl)-5-(4-methoxyphenyl)-1,2,4-thiadiazole iodide
SpectraBase Compound ID JDaVuwkuZ2C
InChI InChI=1S/C14H19N3OS.HI/c1-17(2)10-4-5-13-15-14(19-16-13)11-6-8-12(18-3)9-7-11;/h6-9H,4-5,10H2,1-3H3;1H
InChIKey UXJSQPJOUBFKTF-UHFFFAOYSA-N
Mol Weight 405.3 g/mol
Molecular Formula C14H20IN3OS
Exact Mass 405.037178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WuldYnvzte
Name 3-(3-Dimethylamoniumpropyl)-5-(4-methoxyphenyl)-1,2,4-thiadiazole iodide
Alternate Name(s) 3-(3-Methylaminopentyl)-5-(3,4-dimethoxyphenyl)-1,2,4-thiadiazole hydrochloride 3-[5-(4-methoxyphenyl)-1,2,4-thiadiazol-3-yl]-N,N-dimethyl-1-propanaminium iodide
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Formula C14H20IN3OS
InChI InChI=1S/C14H19N3OS.HI/c1-17(2)10-4-5-13-15-14(19-16-13)11-6-8-12(18-3)9-7-11;/h6-9H,4-5,10H2,1-3H3;1H
InChIKey UXJSQPJOUBFKTF-UHFFFAOYSA-N
Molecular Weight 405.298 g/mol
SMILES [I-].[NH+](CCCc1nsc(n1)-c1ccc(OC)cc1)(C)C
SPLASH splash10-0a4i-9000000000-ca7999b7a81ddcd3c6cb
Source of Spectrum SO-0-1072-7
Wiley ID 1541745