Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TFA

• Formula: C₁₇H₂₃F₃N₄O₄
• Molecular weight: 404.3841
• IUPAC Standard InChI: InChI=1S/C17H23F3N4O4/c1-4-8-23-13-12(22(3)10-21-13)14(25)24(16(23)27)9-6-5-7-11(2)28-15(26)17(18,19)20/h10-11H,4-9H2,1-3H3 Copy

  
• IUPAC Standard InChIKey: ZRXSFVYUNMDMTC-UHFFFAOYSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
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Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Bryce and Burrows, 1980
Bryce, T.A.; Burrows, J.L., Determination of Oxpentifylline and a Metabolite, 1-(5'-Hydroxyhexyl)-3, 7-Dimethylxanthine, by Gas-Liquid Chromatography Using a Nitrogen-Selective Detector, J. Chromatogr., 1980, 181, 3-4, 355-361, https://doi.org/10.1016/S0378-4347(00)81138-X . [all data]

Notes

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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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