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1-[[3-(2-chloro-6-fluorophneyl)-5-methyl-4-isoxazolyl]carbonyl}-2-(methylthio)-1,4,5,6-tetrahydropyrimidine
SpectraBase Compound ID Cx5NwjXDc0L
InChI InChI=1S/C16H15ClFN3O2S/c1-9-12(15(22)21-8-4-7-19-16(21)24-2)14(20-23-9)13-10(17)5-3-6-11(13)18/h3,5-6H,4,7-8H2,1-2H3
InChIKey MLTKNIXNGNNUDX-UHFFFAOYSA-N
Mol Weight 367.83 g/mol
Molecular Formula C16H15ClFN3O2S
Exact Mass 367.055754 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID GynOQb43DmR
Name 1-{[3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYL-4-ISOXAZOLYL]CARBONYL}-2-(METHYLTHIO)-1,4,5,6-TETRAHYDROPYRIMIDINE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number BTB 3626
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClFN3O2S
InChI InChI=1S/C16H15ClFN3O2S/c1-9-12(15(22)21-8-4-7-19-16(21)24-2)14(20-23-9)13-10(17)5-3-6-11(13)18/h3,5-6H,4,7-8H2,1-2H3
InChIKey MLTKNIXNGNNUDX-UHFFFAOYSA-N
Melting Point 116-118C
Molecular Weight 367.825012
Synonyms PYRIMIDINE, 1-//3-/2-CHLORO- 6-FLUOROPHENYL/-5-METHYL-4-ISOXAZOLYL/- CARBONYL/-2-/METHYLTHIO/-1,4,5,6-TETRA- HYDRO-, PYRIMIDINE, 1-//3-/2-CHLORO- 6-FLUOROPHENYL/-5-METHYL-4-ISOXAZOLYL/- CARBONYL/-2-/METHYLTHIO/-1,4,5,6-TETRA- HYDRO-,
Technique KBr WAFER