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N-{3-cyano-4,5-dimethyl-1-[(3-pyridyl)methyl]pyrrol-2-yl}-alpha,alpha,alpha-trifluoro-p-toluamide
SpectraBase Compound ID 9llPHXVeW87
InChI InChI=1S/C21H17F3N4O/c1-13-14(2)28(12-15-4-3-9-26-11-15)19(18(13)10-25)27-20(29)16-5-7-17(8-6-16)21(22,23)24/h3-9,11H,12H2,1-2H3,(H,27,29)
InChIKey HJWPTIUXBWDNSR-UHFFFAOYSA-N
Mol Weight 398.39 g/mol
Molecular Formula C21H17F3N4O
Exact Mass 398.135446 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9XTkVvTQOxx
Name N-{3-CYANO-4,5-DIMETHYL-1-[(3-PYRIDYL)METHYL]PYRROL-2-YL}-alpha,alpha,alpha-TRIFLUORO-p-TOLUAMIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17F3N4O
InChI InChI=1S/C21H17F3N4O/c1-13-14(2)28(12-15-4-3-9-26-11-15)19(18(13)10-25)27-20(29)16-5-7-17(8-6-16)21(22,23)24/h3-9,11H,12H2,1-2H3,(H,27,29)
InChIKey HJWPTIUXBWDNSR-UHFFFAOYSA-N
Melting Point 179-180C
Molecular Weight 398.394012
Synonyms P-TOLUAMIDE, N-/3-CYANO-4,5-DIMETHYL- 1-//3-PYRIDYL/METHYL/PYRROL-2-YL/- A,A,A-TRIFLUORO-,
Technique KBr WAFER