4-ethyl-2,5-dimethoxy-β-phenethylamine-M, (hydroxyl-N-acetyl)-isomer 2, acetylated

Formula: C₁₆H₂₃NO₅
Molecular weight: 309.3575
IUPAC Standard InChI: InChI=1S/C16H23NO5/c1-6-13-14(20-4)9-12(7-8-17-10(2)18)15(21-5)16(13)22-11(3)19/h9H,6-8H2,1-5H3,(H,17,18)
IUPAC Standard InChIKey: GPYYHHRPVIZBAX-UHFFFAOYSA-N
Chemical structure:
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Gas Chromatography

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

Kovats' RI, non-polar column, temperature ramp

Column type	Active phase	I	Reference	Comment
Capillary	HP-1	2420.	Theobald and Maurer, 2006	12. m/0.2 mm/0.33 μm, He, 100. C @ 3. min, 30. K/min, 310. C @ 8. min

References

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Theobald and Maurer, 2006
Theobald, D.S.; Maurer, H.H., Studies on the metabolism and toxicological detection of the designer drug 4-ethyl-2,5-dimethoxy-β-phenethylamine (2C-E) in rat urine using gas chromatographic-mass spectrometric techniques, J. Chromatogr. B, 2006, 842, 2, 76-90, https://doi.org/10.1016/j.jchromb.2006.03.001 . [all data]

Notes

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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