Spectrum Details
MiMe ID:MMDBc0000395
Compound name:3-Methylxanthine
Spectrum type:LC-MS/MS Spectrum - Quattro_QQQ 10V, Positive (Annotated)
Splash Key:splash10-004i-1900000000-ddc5f6a902d7bbd1fb47 View in MoNA
Spectrum View
Experimental Conditions
Sample Assessment:Excellent
Spectrum Assessment:Excellent
Instrument Type:Quattro_QQQ
Collision Energy Level:low
Collision Energy Voltage:10
Ionization Mode:Positive
Documentation
Document DescriptionDownload
Spectra image with peak assignments (PNG)Download file17.3 KB
List of m/z values for the spectrum (TXT)Download file1.11 KB
Generated list of m/z values for the spectrum (TXT-20190109-20465-91NHM)Download file522 Bytes
Dissolution_of_Standard_Samples_for_MSMS_Protocol_SOP_020_v1 (DOC)Download file49 KB
Conducting_MSMS_Experiments_Protocol_SOP_021_v2 (DOC)Download file49.5 KB
mzML formatted file (MZML)Download file4.34 KB
References
  1. Wishart DS, Knox C, Guo AC, Eisner R, Young N, Gautam B, Hau DD, Psychogios N, Dong E, Bouatra S, Mandal R, Sinelnikov I, Xia J, Jia L, Cruz JA, Lim E, Sobsey CA, Shrivastava S, Huang P, Liu P, Fang L, Peng J, Fradette R, Cheng D, Tzur D, Clements M, Lewis A, De Souza A, Zuniga A, Dawe M, Xiong Y, Clive D, Greiner R, Nazyrova A, Shaykhutdinov R, Li L, Vogel HJ, Forsythe I: HMDB: a knowledgebase for the human metabolome. Nucleic Acids Res. 2009 Jan;37(Database issue):D603-10. doi: 10.1093/nar/gkn810. Epub 2008 Oct 25. [PubMed: 18953024 ]