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. Author manuscript; available in PMC: 2013 Sep 4.
Published in final edited form as: Anal Chem. 2012 Aug 21;84(17):7456–7462. doi: 10.1021/ac301398h

Table 2.

The PCDL search result for isomer 4120a, including the m/z of the precursor ion, collision energy, forward and reverse matching scores and the neutral mass in the library.

Name Precursor CE Match Score Reverse Score Mass (Library)
4120a 611.2 4.5 75.6 79.1 1220.5
IFLNH I 611.2 4.5 74.6 77.5 1220.5
MFpLNH IV 611.2 4.5 71.3 72 1220.5
4120b unknown 611.2 4.5 67 65.8 1220.5