MassBank Record: KZ000229



 4-Hydroxy-L-proline; GC-EI-TOF; MS; 3 TMS; BP:140 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KZ000229
RECORD_TITLE: 4-Hydroxy-L-proline; GC-EI-TOF; MS; 3 TMS; BP:140
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_01730_P000128

CH$NAME: L-Hydroxyproline CH$NAME: 4-Hydroxy-L-proline CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C5H9NO3 CH$EXACT_MASS: 131.05824 CH$SMILES: OC(C1)CC(N1)C(O)=O CH$IUPAC: InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3?,4-/m0/s1 CH$LINK: CAS 51-35-4 CH$LINK: KEGG C01015 CH$LINK: INCHIKEY PMMYEEVYMWASQN-BKLSDQPFSA-N
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 1544.2 AC$CHROMATOGRAPHY: RETENTION_TIME 714.713 sec
MS$FOCUSED_ION: BASE_PEAK 140 MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-000x-0940000000-a668e3cb89c27d5aaaec PK$NUM_PEAK: 140 PK$PEAK: m/z int. rel.int. 82 6 6 83 28 28 84 26 26 85 26 26 86 30 30 87 18 18 88 6 6 89 14 14 90 2 2 91 1 1 92 2 2 93 4 4 94 8 8 95 8 8 96 11 11 97 15 15 98 21 21 99 26 26 100 67 67 101 87 87 102 20 20 103 31 31 104 4 4 105 11 11 106 2 2 107 1 1 108 4 4 109 2 2 110 5 5 111 11 11 112 18 18 113 24 24 114 15 15 115 27 27 116 26 26 117 29 29 118 6 6 119 16 16 120 2 2 121 1 1 122 1 1 124 49 49 125 7 7 126 12 12 127 2 2 128 11 11 129 38 38 130 9 9 131 47 47 132 11 11 133 90 90 134 13 13 135 8 8 136 1 1 138 5 5 139 20 20 140 999 999 141 152 152 142 146 146 143 22 22 144 6 6 145 3 3 146 2 2 147 276 276 148 47 47 149 38 38 150 5 5 151 2 2 152 5 5 153 1 1 154 2 2 155 2 2 156 15 15 157 6 6 158 22 22 159 5 5 160 2 2 161 1 1 166 4 4 167 1 1 168 3 3 170 15 15 171 2 2 172 12 12 173 4 4 175 8 8 176 2 2 177 3 3 178 1 1 180 1 1 182 3 3 183 1 1 184 2 2 185 1 1 186 1 1 187 7 7 188 27 27 189 9 9 190 3 3 191 3 3 192 1 1 193 1 1 196 2 2 197 1 1 198 3 3 199 1 1 200 2 2 201 1 1 202 1 1 203 3 3 204 1 1 205 1 1 212 1 1 214 24 24 215 5 5 216 8 8 217 2 2 218 2 2 221 1 1 228 8 8 229 5 5 230 820 820 231 188 188 232 81 81 233 12 12 234 2 2 240 4 4 241 1 1 242 1 1 244 1 1 258 3 3 259 2 2 260 1 1 304 37 37 305 13 13 306 6 6 307 1 1 332 21 21 333 7 7 334 3 3 //

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