MassBank Record: JP002683



 1-O-1'-TETRADECENYL-2,3-DI-O-ACETYL GLYCEROL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002683
RECORD_TITLE: 1-O-1'-TETRADECENYL-2,3-DI-O-ACETYL GLYCEROL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 1-O-1'-TETRADECENYL-2,3-DI-O-ACETYL GLYCEROL CH$COMPOUND_CLASS: N/A CH$FORMULA: C21H38O5 CH$EXACT_MASS: 370.27192 CH$SMILES: CCCCCCCCCCCCC=COCC(COC(C)=O)OC(C)=O CH$IUPAC: InChI=1S/C21H38O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-21(26-20(3)23)18-25-19(2)22/h15-16,21H,4-14,17-18H2,1-3H3/b16-15+
AC$INSTRUMENT: SHIMADZU LKB-9000B AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 40 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0f6t-8930000000-345a983de838794f38f5 PK$NUM_PEAK: 125 PK$PEAK: m/z int. rel.int. 43 7.1 71 54 7.3 73 55 14.3 143 56 9.1 91 57 51.2 512 58 5.7 57 60 5.9 59 61 0.61 6 67 6.9 69 68 11 110 69 33.6 336 70 1.74 17 71 84.2 842 72 5.1 51 73 32.5 325 74 0.61 6 79 4.6 46 80 3.5 35 81 14.9 149 82 2.89 29 83 80.4 804 84 14.7 147 85 84.1 841 86 2.37 24 87 12.8 128 91 1.1 11 93 1.6 16 94 0.28 3 95 29.7 297 96 33.2 332 97 72.3 723 98 2.49 25 99 54.4 544 100 78.4 784 101 29.5 295 102 0.49 5 103 51.6 516 104 7.1 71 105 2.7 27 106 0.53 5 107 3.3 33 109 15.3 153 110 23.1 231 111 5.02 50 112 29.6 296 113 35.2 352 114 5.9 59 115 1.37 14 116 41.5 415 117 99.99 999 118 11.1 111 119 0.32 3 121 5.9 59 122 6.1 61 123 17.3 173 124 1.62 16 125 32.7 327 126 5.2 52 127 32.3 323 135 0.75 8 136 2.4 24 137 12.2 122 138 16.1 161 139 1.69 17 140 8.5 85 141 20.2 202 144 1 10 145 2.43 24 146 1.2 12 147 3 30 149 12.8 128 151 0.8 8 152 4.9 49 153 5.6 56 155 18.7 187 159 8.78 88 160 9.5 95 161 4.6 46 163 3 30 165 0.55 6 166 10.1 101 167 6.3 63 168 6.4 64 169 1.1 11 177 3.2 32 178 4.4 44 179 5.2 52 180 0.53 5 181 3.1 31 182 1.6 16 183 10.5 105 185 0.24 2 189 6.5 65 192 5.1 51 193 4 40 194 0.55 6 195 7.6 76 196 6.6 66 197 4.4 44 209 0.43 4 210 5.5 55 213 4.6 46 221 5.5 55 222 0.93 9 223 10.4 104 224 5.1 51 225 24.2 242 226 0.51 5 237 5.4 54 251 10.9 109 252 4.8 48 253 2.23 22 254 4.9 49 255 49.7 497 256 11.1 111 269 0.49 5 280 11.8 118 281 3.8 38 283 20.1 201 284 0.42 4 285 8.6 86 297 78.3 783 298 17.4 174 325 20.9 209 326 4.9 49 //