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1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]-3-[3-(methylthio)propyl]-

View entire compound with spectra: 1 FTIR

1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]-3-[3-(methylthio)propyl]-
SpectraBase Compound ID IpSAyLlH1xo
InChI InChI=1S/C20H16ClF3N4O6S/c1-35-8-2-7-26-17(29)25-18(30)27(19(26)31)15-10-12(4-5-14(15)28(32)33)34-16-6-3-11(9-13(16)21)20(22,23)24/h3-6,9-10H,2,7-8H2,1H3,(H,25,29,30)
InChIKey XKONPWVLRXDTJF-UHFFFAOYSA-N
Mol Weight 532.88 g/mol
Molecular Formula C20H16ClF3N4O6S
Exact Mass 532.043118 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HCejS43Nlp1
Name 1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]-3-[3-(methylthio)propyl]-
CAS Registry Number 86607-03-6
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H16ClF3N4O6S
InChI InChI=1S/C20H16ClF3N4O6S/c1-35-8-2-7-26-17(29)25-18(30)27(19(26)31)15-10-12(4-5-14(15)28(32)33)34-16-6-3-11(9-13(16)21)20(22,23)24/h3-6,9-10H,2,7-8H2,1H3,(H,25,29,30)
InChIKey XKONPWVLRXDTJF-UHFFFAOYSA-N
Instrument Name Bruker IFS 112
Technique KBr-Pellet