MassBank Record: PB000481



 Dopamine; LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PB000481
RECORD_TITLE: Dopamine; LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
DATE: 2016.01.19 (Created 2008.01.02, modified 2013.06.04)
AUTHORS: Boettcher C, Institute of Plant Biochemistry, Halle, Germany
LICENSE: CC BY-SA
COMMENT: IPB_RECORD: 268
COMMENT: CONFIDENCE: 

CH$NAME: Dopamine CH$NAME: 4-(2-aminoethyl)benzene-1,2-diol CH$COMPOUND_CLASS: Natural Product; biogenic amine CH$FORMULA: C8H11NO2 CH$EXACT_MASS: 153.07898 CH$SMILES: C1=CC(=C(C=C1CCN)O)O 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: INCHIKEY VYFYYTLLBUKUHU-UHFFFAOYSA-N CH$LINK: KEGG C03758 CH$LINK: PUBCHEM CID:681
AC$INSTRUMENT: API QSTAR Pulsar i AC$INSTRUMENT_TYPE: LC-ESI-QTOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40 eV AC$MASS_SPECTROMETRY: IONIZATION ESI
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0006-9000000000-fdcbbd6eae324ae068b8 PK$NUM_PEAK: 11 PK$PEAK: m/z int. rel.int. 41.040 67.041 5 53.040 57.918 4 63.024 118.738 10 65.039 4975.257 496 77.038 56.259 4 79.054 178.038 16 81.070 90.678 8 91.054 10000.000 999 94.042 101.598 9 119.048 353.036 34 137.056 47.689 3 //