MassBank Record: KZ000154



 L-Glutamine; GC-EI-TOF; MS; 3 TMS; BP:156 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000154
RECORD_TITLE: L-Glutamine; GC-EI-TOF; MS; 3 TMS; BP:156
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_05054_P000050

CH$NAME: L-Glutamine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H10N2O3 CH$EXACT_MASS: 146.06914 CH$SMILES: NC(=O)CC[C@H](N)C(O)=O CH$IUPAC: InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 CH$LINK: CAS 56-85-9 CH$LINK: KEGG C00064 CH$LINK: INCHIKEY ZDXPYRJPNDTMRX-VKHMYHEASA-N CH$LINK: COMPTOX DTXSID1023100
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$CHROMATOGRAPHY: RETENTION_TIME 872.329 sec
MS$FOCUSED_ION: BASE_PEAK 156 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0a4i-0910000000-134e80840320dadf6ad1 PK$NUM_PEAK: 170 PK$PEAK: m/z int. rel.int. 82 9 9 83 76 76 84 50 50 85 18 18 86 22 22 87 10 10 88 4 4 89 9 9 90 9 9 91 3 3 92 3 3 93 3 3 94 3 3 95 2 2 96 3 3 97 4 4 98 18 18 99 10 10 100 103 103 101 28 28 102 17 17 103 19 19 104 3 3 105 4 4 106 1 1 107 2 2 108 1 1 109 1 1 110 5 5 111 4 4 112 32 32 113 20 20 114 74 74 115 55 55 116 56 56 117 23 23 118 7 7 119 7 7 120 1 1 121 2 2 123 1 1 124 2 2 125 2 2 126 39 39 127 9 9 128 117 117 129 35 35 130 40 40 131 93 93 132 35 35 133 63 63 134 11 11 135 6 6 136 1 1 137 1 1 138 1 1 139 85 85 140 31 31 141 9 9 142 30 30 143 5 5 144 10 10 145 48 48 146 14 14 147 243 243 148 48 48 149 46 46 150 7 7 151 3 3 152 1 1 153 5 5 154 12 12 155 442 442 156 999 999 157 163 163 158 52 52 159 7 7 160 4 4 161 2 2 162 3 3 163 2 2 166 1 1 167 5 5 168 2 2 169 1 1 170 2 2 171 3 3 172 10 10 173 8 8 174 5 5 175 1 1 176 1 1 177 1 1 181 1 1 182 2 2 183 4 4 184 1 1 185 2 2 186 2 2 187 1 1 188 18 18 189 5 5 190 3 3 191 1 1 192 1 1 197 1 1 198 1 1 199 1 1 200 3 3 201 1 1 202 4 4 203 70 70 204 18 18 205 7 7 206 2 2 211 6 6 212 2 2 213 5 5 214 5 5 215 2 2 216 10 10 217 7 7 218 22 22 219 7 7 220 2 2 221 6 6 222 1 1 223 1 1 226 1 1 227 16 16 228 8 8 229 39 39 230 21 21 231 7 7 232 12 12 233 2 2 234 1 1 239 1 1 240 1 1 241 1 1 242 1 1 243 2 2 244 7 7 245 102 102 246 23 23 247 9 9 248 2 2 256 1 1 257 8 8 258 4 4 259 1 1 272 5 5 273 9 9 274 2 2 275 1 1 291 1 1 300 1 1 301 11 11 302 4 4 303 2 2 304 1 1 344 2 2 345 1 1 346 3 3 347 15 15 348 4 4 349 2 2 361 1 1 362 4 4 363 1 1 //

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