MassBank Record: NGA01227



 Foliosidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: NGA01227
RECORD_TITLE: Foliosidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa TCSRS, RIKEN, Okano ACSRS, RIKEN, CSRS, RIKEN
LICENSE: BY-CC
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: 307.34947 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: PUBCHEM CID:2114844 17346697 CH$LINK: INCHIKEY IUPYLWAXGAJZQC-UHFFFAOYSA-N
AC$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$SPLASH: splash10-0a4i-0039000000-533e59675c0327318b01 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 289.4 1.09 1 289.5 2.24 2 289.6 4.15 4 289.7 7.44 7 289.8 12.84 12 289.9 20.2 20 290.0 27.63 27 290.1 32.44 32 290.2 33.31 33 290.3 30.63 30 290.4 24.91 24 290.5 16.6 16 290.6 7.65 7 290.7 1.21 1 307.3 0.99 0 307.4 3.08 3 307.5 6.45 6 307.6 11.41 11 307.7 20.0 19 307.8 34.96 34 307.9 55.96 55 308.0 77.81 77 308.1 93.86 93 308.2 100.0 99 308.3 94.39 94 308.4 76.16 76 308.5 48.32 48 308.6 20.19 20 308.7 2.29 2 //