ACCESSION: MSBNK-RIKEN_NPDepo-NGA01377
RECORD_TITLE: Foliosidine acetonide; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [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$NAME: Foliosidine acetonide
CH$COMPOUND_CLASS: Alkaloids
CH$FORMULA: C₁₉H₂₅NO₅
CH$EXACT_MASS: 347.4148
CH$SMILES: COc1cc(=O)n(C)c2c(OCC3OC(C)(C)OC3(C)C)cccc12
CH$IUPAC: InChI=1S/C19H25NO5/c1-18(2)15(24-19(3,4)25-18)11-23-13-9-7-8-12-14(22-6)10-16(21)20(5)17(12)13/h7-10,15H,11H2,1-6H3
CH$LINK: INCHIKEY HFXBOPGUQAUMHA-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:2837664

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$SPLASH: splash10-0a4l-0090000000-a0b4c480d2764c980b10
PK$NUM_PEAK: 83
PK$PEAK: m/z int. rel.int.
  173.7 2.91 2
  173.8 4.44 4
  173.9 6.08 6
  174.0 7.29 7
  174.1 7.72 7
  174.2 7.29 7
  174.3 5.99 5
  174.4 3.99 3
  187.7 2.86 2
  187.8 4.49 4
  187.9 6.35 6
  188.0 7.82 7
  188.1 8.44 8
  188.2 8.14 8
  188.3 7.0 6
  188.4 5.1 5
  188.5 2.85 2
  203.6 2.78 2
  203.7 4.74 4
  203.8 7.84 7
  203.9 11.23 11
  204.0 13.81 13
  204.1 15.08 15
  204.2 15.11 15
  204.3 14.24 14
  204.4 13.37 13
  204.5 13.64 13
  204.6 16.16 16
  204.7 23.55 23
  204.8 39.51 39
  204.9 63.33 63
  205.0 86.71 86
  205.1 100.0 99
  205.2 99.69 99
  205.3 87.23 87
  205.4 65.04 64
  205.5 38.58 38
  205.6 17.9 17
  205.8 17.25 17
  205.9 28.23 28
  206.0 36.61 36
  206.1 39.89 39
  206.2 39.03 38
  206.3 34.88 34
  206.4 27.13 27
  206.5 16.44 16
  206.6 6.14 6
  206.7 0.21 0
  217.6 1.63 1
  217.7 2.93 2
  217.8 5.24 5
  217.9 8.04 8
  218.0 10.21 10
  218.1 10.95 10
  218.2 10.26 10
  218.3 8.48 8
  218.4 5.93 5
  218.5 3.14 3
  229.6 2.16 2
  229.7 3.44 3
  229.8 5.35 5
  229.9 7.57 7
  230.0 9.53 9
  230.1 10.75 10
  230.2 10.83 10
  230.3 9.47 9
  230.4 6.77 6
  230.5 3.55 3
  289.3 0.98 0
  289.4 2.44 2
  289.5 4.92 4
  289.6 9.4 9
  289.7 18.14 18
  289.8 33.21 33
  289.9 53.6 53
  290.0 74.38 74
  290.1 89.23 89
  290.2 93.53 93
  290.3 85.01 84
  290.4 64.26 64
  290.5 36.82 36
  290.6 12.58 12
  290.7 0.21 0
//