ACCESSION: MSBNK-RIKEN_NPDepo-NGA01380
RECORD_TITLE: Foliosidine acetonide; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [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$SPLASH: splash10-0002-0059000000-cd28f67201e95389f469
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  289.4 1.77 1
  289.5 3.84 3
  289.6 7.21 7
  289.7 13.13 13
  289.8 23.01 22
  289.9 36.38 36
  290.0 49.96 49
  290.1 59.44 59
  290.2 61.88 61
  290.3 56.05 55
  290.4 42.36 42
  290.5 24.32 24
  290.6 8.33 8
  290.7 0.27 0
  347.3 0.5 0
  347.4 1.69 1
  347.5 4.1 4
  347.6 8.32 8
  347.7 15.93 15
  347.8 29.28 29
  347.9 48.91 48
  348.0 71.24 71
  348.1 89.96 89
  348.2 100.0 99
  348.3 98.79 98
  348.4 84.85 84
  348.5 59.31 59
  348.6 29.59 29
  348.7 6.78 6
  348.8 0.0 0
//