MassBank Record: PR010058



 L-Glutamic acid; GC-EI-TOF; MS; 3 TMS; BP:73 
Mass Spectrum
Chemical Structure
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ACCESSION: PR010058
RECORD_TITLE: L-Glutamic acid; GC-EI-TOF; MS; 3 TMS; BP:73
DATE: 2016.01.19 (Created 2006.12.21, modified 2011.05.06)
AUTHORS: Kusano M, Fukushima A, Plant Science Center, RIKEN.
LICENSE: CC BY-SA

CH$NAME: L-Glutamic acid CH$NAME: L-Glutamate CH$NAME: L-Glutaminic acid CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H9NO4 CH$EXACT_MASS: 147.05316 CH$SMILES: OC(=O)CC[C@H](N)C(O)=O CH$IUPAC: InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 CH$LINK: CAS 56-86-0 CH$LINK: CHEBI 16015 CH$LINK: CHEMPDB GLU CH$LINK: KEGG C00025 CH$LINK: NIKKAJI J9.171E CH$LINK: PUBCHEM 3327
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$CHROMATOGRAPHY: RETENTION_INDEX 1607.8 AC$CHROMATOGRAPHY: RETENTION_TIME 398.56 sec
MS$FOCUSED_ION: BASE_PEAK 73 MS$FOCUSED_ION: DERIVATIVE_FORM C14H33NO4Si3 MS$FOCUSED_ION: DERIVATIVE_MASS 363.17174 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00dj-9630000000-1ecc76aab86283892139 PK$NUM_PEAK: 141 PK$PEAK: m/z int. rel.int. 60 16 16 61 27 27 62 2 2 63 3 3 65 1 1 66 13 13 67 3 3 69 1 1 70 9 9 71 6 6 72 35 35 73 999 999 74 100 100 75 246 246 76 24 24 77 45 45 78 3 3 79 8 8 80 1 1 82 6 6 83 8 8 84 213 213 85 21 21 86 12 12 87 6 6 88 3 3 89 5 5 90 1 1 91 1 1 92 1 1 93 2 2 94 1 1 95 3 3 96 2 2 97 2 2 98 9 9 99 8 8 100 82 82 101 17 17 102 9 9 103 13 13 104 2 2 105 3 3 110 2 2 111 1 1 112 11 11 113 13 13 114 20 20 115 18 18 116 8 8 117 15 15 118 3 3 119 5 5 126 2 2 127 1 1 128 281 281 129 57 57 130 23 23 131 24 24 132 16 16 133 48 48 134 8 8 135 5 5 140 26 26 141 4 4 142 3 3 143 3 3 144 3 3 145 2 2 146 2 2 147 177 177 148 34 34 149 41 41 150 5 5 151 2 2 154 2 2 155 3 3 156 157 157 157 27 27 158 29 29 159 5 5 160 2 2 161 1 1 162 1 1 163 2 2 168 1 1 170 1 1 172 3 3 173 2 2 174 10 10 175 2 2 176 1 1 177 1 1 184 1 1 186 3 3 187 1 1 188 2 2 189 2 2 190 1 1 191 1 1 198 1 1 202 5 5 203 4 4 204 19 19 205 4 4 206 2 2 214 6 6 215 1 1 216 3 3 217 1 1 218 20 20 219 5 5 220 2 2 221 6 6 222 1 1 229 1 1 230 62 62 231 14 14 232 7 7 233 1 1 244 1 1 245 6 6 246 388 388 247 84 84 248 36 36 249 5 5 250 1 1 258 10 10 259 2 2 260 1 1 273 1 1 274 3 3 275 1 1 276 1 1 320 3 3 348 16 16 349 5 5 350 2 2 363 7 7 364 2 2 365 1 1 //