Aprobarbital

• Formula: C₁₀H₁₄N₂O₃
• Molecular weight: 210.2298
• IUPAC Standard InChI: InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15) Copy

  
• IUPAC Standard InChIKey: UORJNBVJVRLXMQ-UHFFFAOYSA-N Copy
• CAS Registry Number: 77-02-1
• Chemical structure:
  This structure is also available as a 2d Mol file
• Other names: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylethyl)-5-(2-propenyl)-; Barbituric acid, 5-allyl-5-isopropyl-; Allional; Allonal; Allylisopropylbarbituric acid; Allylisopropylmalonylurea; Allylpropymal; Allypropymal; Alurate; Alurate Elixir Verdum; Aprobarbita; Aprobarbitone; Aprozal; Isonal; Isopropylallylbarbituric acid; Numal; 5-Allyl-5-isopropylbarbituric acid; 5-Isopropyl-5-allylbarbituric acid; 5-Allyl-5-isopropylbarbiturate; 5-Allyl-5-isopropyl-2,4,6(1H,3H,5H)-pyrimidinetrione; NSC 120769; Propallylonal M (des-Br)
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• Information on this page:
  • Van Den Dool and Kratz RI, non-polar column, custom temperature program
  • References
  • Notes
• Other data available:
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • Gas Chromatography
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Van Den Dool and Kratz RI, non-polar column, custom temperature program

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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

References

Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, Notes

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

Aderjan and Bogusz, 1988
Aderjan, R.; Bogusz, M., Nitroalkanes as a multidetector retention index scale for drug identification in gas chromatography, J. Chromatogr., 1988, 454, 345-351, https://doi.org/10.1016/S0021-9673(00)88629-X . [all data]

Notes

Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, References

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