MassBank Record: KO003150



 Dopamine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO003150
RECORD_TITLE: Dopamine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID H078

CH$NAME: Dopamine(2) CH$NAME: 4-(2-Aminoethyl)benzene-1,2-diol CH$NAME: 2-(3,4-Dihydroxyphenyl)ethylamine CH$NAME: 4-(2-Aminoethyl)-1,2-benzenediol CH$NAME: 3,4-Dihydroxyphenethylamine CH$NAME: Dopamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H11NO2 CH$EXACT_MASS: 153.07898 CH$SMILES: NCCc(c1)cc(O)c(O)c1 CH$IUPAC: InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2 CH$LINK: CAS 51-61-6 CH$LINK: CHEBI 18243 CH$LINK: KEGG C03758 CH$LINK: NIKKAJI J4.120C CH$LINK: PUBCHEM SID:6517
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 154 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0006-9300000000-356a4b8f268863c7893e PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 40.700 19802.0 1 45.000 89109.0 1 46.600 14851.5 1 62.700 19802.0 1 65.200 1292080.5 20 66.800 24752.5 1 69.100 44554.5 1 70.900 54455.5 1 74.000 39604.0 1 75.300 19802.0 1 77.100 69307.0 1 79.200 792080.0 12 81.300 1306932.0 20 91.000 64524817.0 999 93.000 94059.5 1 94.200 301980.5 5 97.400 34653.5 1 105.300 49505.0 1 107.200 272277.5 4 108.900 1435645.0 22 117.400 39604.0 1 119.100 16490115.5 255 127.100 19802.0 1 135.900 99010.0 2 137.200 7425750.0 115 //