3-Methylcholanthrene

• Formula: C₂₁H₁₆
• Molecular weight: 268.3517
• IUPAC Standard InChI: InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3 Copy

  
• IUPAC Standard InChIKey: PPQNQXQZIWHJRB-UHFFFAOYSA-N Copy
• CAS Registry Number: 56-49-5
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Benz[j]aceanthrylene, 1,2-dihydro-3-methyl-; Cholanthrene, 3-methyl-; Methylcholanthrene; 20-Methylcholanthrene; 20-MC; 3-MC; 3-Methylcholanthrene-(20); MC; MCA; 3-MCA; Rcra waste number U157; 1,2-Dihydro-3-methylbenz[j]aceanthrylene; Cholanthrene, 20(3)-methyl; NSC 21970
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• Information on this page:
  • Lee's RI, non-polar column, custom temperature program
  • References
  • Notes
• Other data available:
  • Phase change data
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
  • Gas Chromatography
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Lee's 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, Lee's 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.

Tucminen, Wickstrom, et al., 1986
Tucminen, A.; Wickstrom, K.; Pyysalo, H., Determination of Polycyclic Aromatic Compounds by GLC-Selected Ion Monitoring (SIM) Technique, J. Hi. Res. Chromatogr. Chromatogr. Comm., 1986, 9, 8, 469-471, https://doi.org/10.1002/jhrc.1240090813 . [all data]

Shlyakhov, 1984
Shlyakhov, A.F., Gas chromatography in organic geochemistry, Nedra, Moscow, 1984, 221. [all data]

Notes

Go To: Top, Lee's RI, non-polar column, custom temperature program, References

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