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5-(5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL)-1-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)PYRAZOLE

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5-(5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL)-1-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)PYRAZOLE
SpectraBase Compound ID 44wJqBkhiDc
InChI InChI=1S/C20H12ClF3N2OS/c1-11-15-10-14(21)6-7-17(15)28-18(11)16-8-9-25-26(16)19(27)12-2-4-13(5-3-12)20(22,23)24/h2-10H,1H3
InChIKey KHINLJFBQYBXCE-UHFFFAOYSA-N
Mol Weight 420.84 g/mol
Molecular Formula C20H12ClF3N2OS
Exact Mass 420.031096 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID gGyIiiECje
Name 5-(5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL)-1-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)PYRAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12ClF3N2OS
InChI InChI=1S/C20H12ClF3N2OS/c1-11-15-10-14(21)6-7-17(15)28-18(11)16-8-9-25-26(16)19(27)12-2-4-13(5-3-12)20(22,23)24/h2-10H,1H3
InChIKey KHINLJFBQYBXCE-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 148-150C
Molecular Weight 420.84
Solvent CDCl3; Reference=TMS; Temperature 297K