ACCESSION: MSBNK-RIKEN_NPDepo-NGA01228
RECORD_TITLE: Foliosidine; 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$NAME: Foliosidine
CH$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$SPLASH: splash10-0a4i-0009000000-4a06165b87c25ad8a104
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  289.7 1.96 1
  289.8 3.32 3
  289.9 4.98 4
  290.0 6.64 6
  290.1 7.88 7
  290.2 8.37 8
  290.3 7.88 7
  290.4 6.35 6
  290.5 4.04 4
  307.3 1.16 1
  307.4 3.41 3
  307.5 6.7 6
  307.6 11.15 11
  307.7 19.38 19
  307.8 34.96 34
  307.9 57.29 57
  308.0 79.76 79
  308.1 94.96 94
  308.2 100.0 99
  308.3 94.85 94
  308.4 78.61 78
  308.5 52.37 52
  308.6 23.86 23
  308.7 3.94 3
//