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(4-bromophenyl)-(2-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)cyanamide
SpectraBase Compound ID JK50cZYM4Qv
InChI InChI=1S/C11H10BrN5S/c1-16-11(14-10(15-16)18-2)17(7-13)9-5-3-8(12)4-6-9/h3-6H,1-2H3
InChIKey JMHHHOOZSAIJFB-UHFFFAOYSA-N
Mol Weight 324.2 g/mol
Molecular Formula C11H10BrN5S
Exact Mass 322.98403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35efXIr4Pwu
Name (4-bromophenyl)-(2-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)cyanamide
Alternate Name(s) (4-bromophenyl)-[2-methyl-5-(methylthio)-1,2,4-triazol-3-yl]cyanamide
CAS Registry Number 107841-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10BrN5S
InChI InChI=1S/C11H10BrN5S/c1-16-11(14-10(15-16)18-2)17(7-13)9-5-3-8(12)4-6-9/h3-6H,1-2H3
InChIKey JMHHHOOZSAIJFB-UHFFFAOYSA-N
Molecular Weight 324.200 g/mol
SMILES c1(nc(SC)n[n]1C)N(C#N)c1ccc(cc1)Br
SPLASH splash10-00mo-9312000000-1d6e6870b79b48b650a6
Source of Spectrum F-42-2126-4
Wiley ID 1322260