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Wy 14643
SpectraBase Compound ID 4uqDHVPuSS0
InChI InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18)
InChIKey SZRPDCCEHVWOJX-UHFFFAOYSA-N
Mol Weight 323.8 g/mol
Molecular Formula C14H14ClN3O2S
Exact Mass 323.049526 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID KcAwAmXIOkk
Name Wy 14643
Source of Sample Cayman Chemical Company
Catalog Number 70730
Lot Number 0518586-5
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 50892-23-4
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClN3O2S
IUPAC Name [[4-Chloro-6-[(2,3-dimethylphenyl)amino]-2-pyrimidinyl]thio]acetic acid
InChI InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18)
InChIKey SZRPDCCEHVWOJX-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(c1c(c(ccc1)C)C)c1nc(SCC(O)=O)nc(c1)Cl
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms Pirinixic acid
Technique ATR-Neat