ACCESSION: MSBNK-RIKEN_NPDepo-NGA01226
RECORD_TITLE: Foliosidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa T, Okano A, CSRS, RIKEN
LICENSE: CC BY
COMMENT: Origin: Plant
COMMENT: SubCategory_DNP: Alkaloids derived from anthranilic acid, Quinoline alkaloids, Foliosidine alkaloids

CH$NAME: Foliosidine
CH$COMPOUND_CLASS: Alkaloids
CH$FORMULA: C₁₆H₂₁NO₅
CH$EXACT_MASS: 307.3495
CH$SMILES: COc1cc(=O)n(C)c2c(OCC(O)C(C)(C)O)cccc12
CH$IUPAC: InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3
CH$LINK: CAS 2520-38-9
CH$LINK: CHEMSPIDER 2114844 17346697
CH$LINK: INCHIKEY IUPYLWAXGAJZQC-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:2837663

AC$INSTRUMENT: Agilent 6410 Triple Quadrupole LC/MS system
AC$INSTRUMENT_TYPE: LC-ESI-QQQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-052f-0094000000-ac74d4f32d88bd566851
PK$NUM_PEAK: 78
PK$PEAK: m/z int. rel.int.
  203.7 2.86 2
  203.8 4.7 4
  203.9 6.48 6
  204.0 7.71 7
  204.1 8.36 8
  204.2 8.46 8
  204.3 7.92 7
  204.4 6.86 6
  204.5 5.87 5
  204.6 6.05 6
  204.7 9.03 9
  204.8 15.99 15
  204.9 25.52 25
  205.0 33.66 33
  205.1 37.35 37
  205.2 36.59 36
  205.3 32.41 32
  205.4 24.96 24
  205.5 15.53 15
  205.8 10.0 9
  205.9 15.63 15
  206.0 20.0 19
  206.1 21.91 21
  206.2 21.42 21
  206.3 18.66 18
  206.4 13.75 13
  206.5 7.71 7
  206.6 2.5 2
  217.6 1.84 1
  217.7 3.51 3
  217.8 5.75 5
  217.9 7.99 7
  218.0 9.57 9
  218.1 10.22 10
  218.2 10.0 9
  218.3 8.85 8
  218.4 6.64 6
  218.5 3.79 3
  229.6 1.57 1
  229.7 2.83 2
  229.8 4.58 4
  229.9 6.29 6
  230.0 7.36 7
  230.1 7.69 7
  230.2 7.46 7
  230.3 6.57 6
  230.4 4.81 4
  230.5 2.54 2
  289.3 1.5 1
  289.4 3.5 3
  289.5 6.66 6
  289.6 12.28 12
  289.7 23.09 23
  289.8 40.78 40
  289.9 62.98 62
  290.0 83.46 83
  290.1 96.49 96
  290.2 100.0 99
  290.3 93.8 93
  290.4 76.94 76
  290.5 50.64 50
  290.6 22.57 22
  290.7 3.5 3
  307.3 0.92 0
  307.4 3.12 3
  307.5 6.63 6
  307.6 11.68 11
  307.7 19.95 19
  307.8 33.45 33
  307.9 51.39 51
  308.0 69.1 69
  308.1 81.39 81
  308.2 85.86 85
  308.3 81.6 81
  308.4 67.2 67
  308.5 43.84 43
  308.6 18.96 18
  308.7 2.11 2
//