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Methyl 4-[4-(1-Phenyl-5-methylpyrazolyl)]-2-thiazolylacetate Hydrobromide
SpectraBase Compound ID 8wWfIqBfYn6
InChI InChI=1S/C16H15N3O2S.BrH/c1-11-13(9-17-19(11)12-6-4-3-5-7-12)14-10-22-15(18-14)8-16(20)21-2;/h3-7,9-10H,8H2,1-2H3;1H
InChIKey RBRYKKGSQWCJAR-UHFFFAOYSA-N
Mol Weight 394.29 g/mol
Molecular Formula C16H16BrN3O2S
Exact Mass 393.014661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMEIE92Hd0E
Name Methyl 4-[4-(1-Phenyl-5-methylpyrazolyl)]-2-thiazolylacetate Hydrobromide
Alternate Name(s) Methyl 2-[4-(5-methyl-1-phenyl-1H-pyrazol-4-yl)-1,3-thiazol-2-yl]acetate hydrobromide
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Formula C16H16BrN3O2S
InChI InChI=1S/C16H15N3O2S.BrH/c1-11-13(9-17-19(11)12-6-4-3-5-7-12)14-10-22-15(18-14)8-16(20)21-2;/h3-7,9-10H,8H2,1-2H3;1H
InChIKey RBRYKKGSQWCJAR-UHFFFAOYSA-N
Molecular Weight 394.287 g/mol
SMILES Br.c1(c([n](-c2ccccc2)nc1)C)-c1nc(CC(=O)OC)sc1
SPLASH splash10-03di-0069000000-966a1b49e2a73c59c9b0
Source of Spectrum Y-28-1612-24
Wiley ID 1366158