Skip to main content
. Author manuscript; available in PMC: 2017 May 1.
Published in final edited form as: J Am Soc Mass Spectrom. 2016 Mar 14;27(5):757–766. doi: 10.1007/s13361-016-1366-4

Figure 3.

Figure 3

Illustrative metabolic pathway with known metabolites A-D, and proposed structure for unknown metabolite (top). Comparison of experimental IR spectrum of unknown with reference experimental IR spectra for known metabolites (right), depicting diagnostic vibrations via color coding. Zoom-in of 1200-1500 cm−1 region overlay for known A and unknown (left bottom).