MassBank Record: KZ000156



 L-Histidinol; GC-EI-TOF; MS; 3 TMS; BP:154 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000156
RECORD_TITLE: L-Histidinol; GC-EI-TOF; MS; 3 TMS; BP:154
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_05056_P000059

CH$NAME: L-Histidinol CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H11N3O CH$EXACT_MASS: 141.09021 CH$SMILES: C1=C(NC=N1)C[C@@H](CO)N CH$IUPAC: InChI=1S/C6H11N3O/c7-5(3-10)1-6-2-8-4-9-6/h2,4-5,10H,1,3,7H2,(H,8,9)/t5-/m0/s1 CH$LINK: KEGG C00860 CH$LINK: INCHIKEY ZQISRDCJNBUVMM-YFKPBYRVSA-N CH$LINK: COMPTOX DTXSID50863460
AC$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$CHROMATOGRAPHY: RETENTION_INDEX 0.0000 AC$CHROMATOGRAPHY: RETENTION_TIME 914.828 sec
MS$FOCUSED_ION: BASE_PEAK 154 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0udi-1960000000-2bd5915e1e2204265b30 PK$NUM_PEAK: 166 PK$PEAK: m/z int. rel.int. 82 109 109 83 45 45 84 55 55 85 29 29 86 24 24 87 12 12 88 40 40 89 27 27 90 5 5 91 1 1 92 2 2 93 3 3 94 3 3 95 14 14 96 13 13 97 11 11 98 33 33 99 11 11 100 138 138 101 21 21 102 15 15 103 18 18 104 3 3 105 4 4 106 1 1 107 8 8 108 3 3 109 5 5 110 19 19 111 13 13 112 40 40 113 14 14 114 65 65 115 26 26 116 126 126 117 22 22 118 9 9 119 5 5 120 2 2 121 3 3 122 2 2 123 5 5 124 6 6 125 10 10 126 18 18 127 7 7 128 8 8 129 3 3 130 29 29 131 25 25 132 23 23 133 24 24 134 5 5 135 5 5 136 3 3 137 3 3 138 4 4 139 14 14 140 5 5 141 8 8 142 2 2 143 2 2 144 2 2 145 1 1 146 14 14 147 105 105 148 21 21 149 11 11 150 10 10 151 12 12 152 5 5 153 188 188 154 999 999 155 409 409 156 77 77 157 16 16 158 8 8 159 2 2 160 1 1 161 1 1 162 3 3 163 3 3 164 2 2 165 4 4 166 37 37 167 31 31 168 8 8 169 3 3 170 3 3 171 1 1 172 6 6 173 2 2 174 5 5 175 1 1 176 2 2 177 1 1 178 2 2 179 8 8 180 7 7 181 6 6 182 24 24 183 5 5 184 5 5 185 1 1 186 1 1 188 68 68 189 16 16 190 6 6 191 1 1 192 1 1 193 1 1 194 4 4 195 4 4 196 3 3 197 4 4 198 3 3 199 3 3 200 2 2 201 1 1 202 3 3 203 13 13 204 767 767 205 141 141 206 62 62 207 8 8 208 2 2 209 1 1 210 2 2 211 8 8 212 3 3 213 4 4 214 1 1 222 1 1 223 2 2 224 3 3 225 9 9 226 137 137 227 38 38 228 15 15 229 3 3 237 1 1 238 40 40 239 14 14 240 5 5 241 1 1 250 1 1 251 1 1 252 35 35 253 27 27 254 684 684 255 152 152 256 62 62 257 9 9 258 1 1 266 1 1 267 2 2 268 6 6 269 2 2 270 1 1 326 2 2 327 1 1 341 4 4 342 41 41 343 14 14 344 6 6 345 1 1 //

MassBank | Copyright Line
Copyright © since 2006 MassBank Project
Copyright © since 2011 NORMAN Association
Copyright © since 2017 MassBank Consortium
Responsible: Dr. Tobias Schulze (tobias.schulze@ufz.de)