MassBank Record: NGA02506



 Galanthamine; 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: NGA02506
RECORD_TITLE: Galanthamine; 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: Isoquinoline alkaloids, Amaryllidaceae alkaloids

CH$NAME: Galanthamine CH$COMPOUND_CLASS: Alkaloids CH$FORMULA: C17H21NO3 CH$EXACT_MASS: 287.36181999999997 CH$SMILES: COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(C)C2 CH$IUPAC: InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 CH$LINK: CAS 357-70-0 CH$LINK: PUBCHEM CID:9272 CH$LINK: INCHIKEY ASUTZQLVASHGKV-JDFRZJQESA-N
AC$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$SPLASH: splash10-000i-0090000000-59af3e32ec8e512035b2 PK$NUM_PEAK: 63 PK$PEAK: m/z int. rel.int. 212.4 1.22 1 212.5 2.5 2 212.6 4.37 4 212.7 7.01 7 212.8 10.64 10 212.9 14.88 14 213.0 18.64 18 213.1 20.91 20 213.2 21.28 21 213.3 19.36 19 213.4 14.77 14 213.5 8.37 8 213.6 2.61 2 224.6 1.78 1 224.7 3.02 3 224.8 5.03 5 224.9 7.65 7 225.0 9.98 9 225.1 11.1 11 225.2 10.84 10 225.3 9.5 9 225.4 7.21 7 225.5 4.2 4 225.6 1.41 1 230.5 1.98 1 230.6 3.76 3 230.7 6.47 6 230.8 10.38 10 230.9 15.07 15 231.0 19.3 19 231.1 21.83 21 231.2 22.11 22 231.3 19.9 19 231.4 15.14 15 231.5 8.73 8 231.6 2.91 2 269.6 1.62 1 269.7 2.88 2 269.8 4.97 4 269.9 7.99 7 270.0 11.36 11 270.1 13.94 13 270.2 14.92 14 270.3 14.18 14 270.4 11.81 11 270.5 8.03 8 270.6 3.79 3 287.3 0.31 0 287.4 1.57 1 287.5 4.46 4 287.6 9.84 9 287.7 18.68 18 287.8 32.1 32 287.9 50.62 50 288.0 72.0 71 288.1 90.49 90 288.2 100.0 99 288.3 97.25 97 288.4 81.7 81 288.5 55.78 55 288.6 26.96 26 288.7 5.5 5 288.8 0.0 0 //