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4-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-THIOALLOPHANIC ACID, ETHYL ESTER
SpectraBase Compound ID 1qjcz28TVV6
InChI InChI=1S/C12H10F6N2O2S/c1-2-22-10(21)20-9(23)19-8-4-6(11(13,14)15)3-7(5-8)12(16,17)18/h3-5H,2H2,1H3,(H2,19,20,21,23)
InChIKey BOFIDFLVICEYBZ-UHFFFAOYSA-N
Mol Weight 360.27 g/mol
Molecular Formula C12H10F6N2O2S
Exact Mass 360.036718 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FJoPtfDQI4k
Name 4-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-THIOALLOPHANIC ACID, ETHYL ESTER
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number NH 191
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10F6N2O2S
InChI InChI=1S/C12H10F6N2O2S/c1-2-22-10(21)20-9(23)19-8-4-6(11(13,14)15)3-7(5-8)12(16,17)18/h3-5H,2H2,1H3,(H2,19,20,21,23)
InChIKey BOFIDFLVICEYBZ-UHFFFAOYSA-N
Melting Point 164-166C
Molecular Weight 360.283997
Synonyms ALLOPHANIC ACID, 4-/A,A,A,A*,A*,A*- HEXAFLUORO-3,5-XYLYL/-3-THIO-, ETHYL ESTER
Technique KBr WAFER