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VX-702

View entire compound with spectra: 2 FTIR, and 1 Raman

VX-702
SpectraBase Compound ID ASzAV4StTmQ
InChI InChI=1S/C19H12F4N4O2/c20-9-4-5-10(14(23)8-9)16-11(18(24)28)6-7-15(26-16)27(19(25)29)17-12(21)2-1-3-13(17)22/h1-8H,(H2,24,28)(H2,25,29)
InChIKey FYSRKRZDBHOFAY-UHFFFAOYSA-N
Mol Weight 404.32 g/mol
Molecular Formula C19H12F4N4O2
Exact Mass 404.089638 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID FH0Kut7wbJE
Name VX-702
Source of Sample Cayman Chemical Company
Catalog Number 13108
Lot Number 0459319-18
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 745833-23-2
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12F4N4O2
IUPAC Name 6-[(Aminocarbonyl)(2,6-difluorophenyl)amino]-2-(2,4-difluorophenyl)-3-pyridinecarboxamide
InChI InChI=1S/C19H12F4N4O2/c20-9-4-5-10(14(23)8-9)16-11(18(24)28)6-7-15(26-16)27(19(25)29)17-12(21)2-1-3-13(17)22/h1-8H,(H2,24,28)(H2,25,29)
InChIKey FYSRKRZDBHOFAY-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES NC(N(c1nc(c(C(=O)N)cc1)-c1c(cc(cc1)F)F)c1c(cccc1F)F)=O
Source of Spectrum Forensic Spectral Research
Technique ATR-Neat