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Isoxanthopterin
SpectraBase Compound ID HeoXrOkHcPF
InChI InChI=1S/C6H5N5O2/c7-6-10-4-3(5(13)11-6)8-1-2(12)9-4/h1H,(H4,7,9,10,11,12,13)
InChIKey GLKCOBIIZKYKFN-UHFFFAOYSA-N
Mol Weight 179.14 g/mol
Molecular Formula C6H5N5O2
Exact Mass 179.044324 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 99S1cP9CDde
Name Isoxanthopterin
Source of Sample Cayman Chemical Company
Catalog Number 17564
Lot Number 0472719-2
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 529-69-1
Copyright Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N5O2
IUPAC Name 2-Amino-4,7(3H,8H)-pteridinedione
InChI InChI=1S/C6H5N5O2/c7-6-10-4-3(5(13)11-6)8-1-2(12)9-4/h1H,(H4,7,9,10,11,12,13)
InChIKey GLKCOBIIZKYKFN-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N1C(\C=N/C2=C\1\N=C/(NC2=O)N)=O
Source of Spectrum Forensic Spectral Research
Synonyms NSC 118090; NSC 614991
Technique ATR-Neat