MassBank Record: NGA01372



 Galantamine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: NGA01372
RECORD_TITLE: Galantamine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa TCSRS, RIKEN, Okano ACSRS, RIKEN, CSRS, RIKEN
LICENSE: BY-CC
COMMENT: Origin: Plant, Benzazepines

CH$NAME: Galantamine CH$COMPOUND_CLASS: Benzopyranoids CH$FORMULA: C17H21NO3 CH$EXACT_MASS: 287.36181999999997 CH$SMILES: COc1ccc2c3c1OC1CC(O)C=C[C@@]31CCN(C)C2 CH$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$LINK: INCHIKEY ASUTZQLVASHGKV-AJUCZRQESA-N
AC$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$SPLASH: splash10-03di-1790000000-20c97fc6895c650fbfdb PK$NUM_PEAK: 125 PK$PEAK: m/z int. rel.int. 54.6 1.87 1 54.7 3.11 3 54.8 4.54 4 54.9 5.74 5 55.0 6.38 6 55.1 6.39 6 55.2 5.88 5 55.3 4.84 4 55.4 3.25 3 57.6 2.4 2 57.7 4.17 4 57.8 6.41 6 57.9 8.5 8 58.0 9.81 9 58.1 10.11 10 58.2 9.56 9 58.3 8.2 8 58.4 5.95 5 58.5 3.18 3 174.6 1.96 1 174.7 3.21 3 174.8 4.99 4 174.9 6.84 6 175.0 8.19 8 175.1 8.86 8 175.2 8.95 8 175.3 8.26 8 175.4 6.43 6 175.5 3.7 3 178.8 2.6 2 178.9 3.74 3 179.0 4.89 4 179.1 5.66 5 179.2 5.75 5 179.3 5.04 5 179.4 3.59 3 180.6 1.89 1 180.7 2.99 2 180.8 4.45 4 180.9 6.28 6 181.0 8.03 8 181.1 9.06 9 181.2 9.11 9 181.3 8.44 8 181.4 7.17 7 181.8 5.81 5 181.9 8.27 8 182.0 10.19 10 182.1 11.11 11 182.2 10.99 10 182.3 9.66 9 182.4 7.06 7 182.5 3.98 3 184.8 2.91 2 184.9 4.18 4 185.0 5.53 5 185.1 6.6 6 185.2 7.06 7 185.3 6.65 6 185.4 5.24 5 185.5 3.12 3 196.7 2.51 2 196.8 4.26 4 196.9 6.19 6 197.0 7.52 7 197.1 7.9 7 197.2 7.87 7 197.3 8.09 8 197.4 8.56 8 197.5 9.49 9 197.6 12.58 12 197.7 19.97 19 197.8 31.37 31 197.9 43.38 43 198.0 52.32 52 198.1 56.69 56 198.2 55.98 55 198.3 48.89 48 198.4 35.04 35 198.5 18.26 18 198.6 5.2 5 202.7 2.21 2 202.8 3.62 3 202.9 5.36 5 203.0 6.93 6 203.1 7.84 7 203.2 7.85 7 203.3 6.9 6 203.4 5.06 5 203.5 2.78 2 212.2 1.21 1 212.3 2.49 2 212.4 5.56 5 212.5 10.5 10 212.6 18.04 18 212.7 30.59 30 212.8 49.6 49 212.9 71.66 71 213.0 89.78 89 213.1 99.35 99 213.2 100.0 99 213.3 91.06 90 213.4 70.46 70 213.5 41.22 41 213.6 14.1 14 213.7 0.0 0 224.7 2.55 2 224.8 3.79 3 224.9 5.53 5 225.0 7.03 7 225.1 7.65 7 225.2 7.45 7 225.3 6.7 6 225.4 5.3 5 225.5 3.22 3 230.6 1.99 1 230.7 3.28 3 230.8 5.27 5 230.9 7.78 7 231.0 10.09 10 231.1 11.42 11 231.2 11.37 11 231.3 9.89 9 231.4 7.13 7 231.5 3.75 3 //