MassBank Record: KZ000029



 Ethanolamine; GC-EI-TOF; MS; 3 TMS; BP:174 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000029
RECORD_TITLE: Ethanolamine; GC-EI-TOF; MS; 3 TMS; BP:174
DATE: 2016.01.19 (2009.03.11, 2011.05.06)
AUTHORS: Ara TKazusa DNA Research Institute, Morishita YKazusa DNA Research Institute, Shibata DKazusa DNA Research Institute, Kazusa DNA Research Institute
LICENSE: CC BY-SA
COMMENT: MassBase peak ID: MDGC1_01495_P000088

CH$NAME: Ethanolamine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C2H7NO CH$EXACT_MASS: 61.05276 CH$SMILES: NCCO CH$IUPAC: InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2 CH$LINK: CAS 141-43-5 CH$LINK: KEGG C00189 CH$LINK: INCHIKEY HZAXFHJVJLSVMW-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID6022000
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies AC$INSTRUMENT_TYPE: GC-EI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: COLUMN_NAME DB-17MS AC$CHROMATOGRAPHY: RETENTION_INDEX 1247.3 AC$CHROMATOGRAPHY: RETENTION_TIME 529.512 sec
MS$FOCUSED_ION: BASE_PEAK 174 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00di-1900000000-b64e859a0bfc46cdfcbf PK$NUM_PEAK: 64 PK$PEAK: m/z int. rel.int. 84 9 9 85 12 12 86 425 425 87 57 57 88 26 26 89 16 16 91 1 1 99 5 5 100 429 429 101 61 61 102 56 56 103 24 24 104 4 4 112 1 1 113 12 12 114 54 54 115 23 23 116 18 18 117 37 37 118 8 8 119 19 19 120 1 1 128 1 1 129 3 3 130 67 67 131 49 49 132 20 20 133 98 98 134 18 18 135 8 8 137 1 1 142 1 1 143 2 2 144 11 11 145 4 4 146 11 11 147 216 216 148 35 35 149 13 13 150 2 2 158 12 12 159 3 3 160 3 3 162 1 1 172 21 21 173 2 2 174 999 999 175 219 219 176 92 92 177 14 14 178 1 1 188 9 9 189 2 2 190 1 1 191 1 1 202 1 1 204 1 1 260 1 1 261 1 1 262 15 15 263 3 3 264 2 2 276 1 1 277 1 1 //

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