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PD 184161
SpectraBase Compound ID 5uw8Hfwt7e6
InChI InChI=1S/C17H13BrClF2IN2O2/c18-11-6-10(17(25)24-26-7-8-1-2-8)16(15(21)14(11)20)23-13-4-3-9(22)5-12(13)19/h3-6,8,23H,1-2,7H2,(H,24,25)
InChIKey VJNZMSLGVUSPCF-UHFFFAOYSA-N
Mol Weight 557.56 g/mol
Molecular Formula C17H13BrClF2IN2O2
Exact Mass 555.88617 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 1TXcJUzKQjP
Name PD 184161
Source of Sample Cayman Chemical Company
Catalog Number 10012431
Lot Number 0448365-15
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 212631-67-9
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrClF2IN2O2
IUPAC Name 5-Bromo-2-[(2-chloro-4-iodophenyl)amino]-N-(cyclopropylmethoxy)-3,4-difluorobenzamide
InChI InChI=1S/C17H13BrClF2IN2O2/c18-11-6-10(17(25)24-26-7-8-1-2-8)16(15(21)14(11)20)23-13-4-3-9(22)5-12(13)19/h3-6,8,23H,1-2,7H2,(H,24,25)
InChIKey VJNZMSLGVUSPCF-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(C(c1cc(c(c(c1Nc1ccc(cc1Cl)I)F)F)Br)=O)OCC1CC1
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Technique ATR-Neat