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A-771726
SpectraBase Compound ID GsylDydo5Vv
InChI InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7-
InChIKey UTNUDOFZCWSZMS-YFHOEESVSA-N
Mol Weight 270.21 g/mol
Molecular Formula C12H9F3N2O2
Exact Mass 270.061612 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 6FBRRWfrf0E
Name A-771726
Source of Sample Cayman Chemical Company
Catalog Number 14404
Lot Number 0474764-6
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 163451-81-8
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F3N2O2
IUPAC Name 2-Cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]-2Z-butenamide
InChI InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7-
InChIKey UTNUDOFZCWSZMS-YFHOEESVSA-N
Instrument Name Bio-Rad FTS
SMILES N(c1ccc(cc1)C(F)(F)F)C(\C(=C\(C)O)C#N)=O
Source of Spectrum Forensic Spectral Research
Synonyms Flucyamide; HMR 1726; SU 20; Teriflunomide
Technique ATR-Neat