MassBank Record: JP002660



 TRIACONTANE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002660
RECORD_TITLE: TRIACONTANE; 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$NAME: TRIACONTANE CH$COMPOUND_CLASS: N/A CH$FORMULA: C30H62 CH$EXACT_MASS: 422.48515 CH$SMILES: C(CCCCCCCCCCCCCCCCCCCCCCCCC)CCCC CH$IUPAC: InChI=1S/C30H62/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-30H2,1-2H3
AC$INSTRUMENT: SHIMADZU LKB-9000B AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4l-9100000000-9b9337f2e1015ae42f14 PK$NUM_PEAK: 178 PK$PEAK: m/z int. rel.int. 55 99.99 999 41 13.2 132 42 3.8 38 43 31.8 318 44 29.7 297 45 2 20 47 0.8 8 50 0.18 2 51 2.1 21 52 1.7 17 53 1.2 12 54 0.21 2 57 44.3 443 58 2.3 23 59 0.1 1 60 0.05 1 65 0.1 1 67 2.1 21 68 1.7 17 69 0.78 8 70 4.7 47 71 28.8 288 72 1.9 19 73 0.1 1 75 0.2 2 76 0.1 1 77 0.6 6 78 0.08 1 79 0.4 4 80 0.2 2 81 1 10 82 0.25 3 83 6.8 68 84 3.3 33 85 20.5 205 86 0.11 1 87 0.4 4 89 0.3 3 90 0.3 3 91 0.1 1 92 0.1 1 93 0.7 7 95 1.2 12 96 0.02 0 97 5.7 57 98 1.4 14 99 5.4 54 100 0.08 1 101 0.3 3 102 0.4 4 105 0.1 1 107 0.11 1 108 1.2 12 109 1.1 11 110 0.2 2 111 0.33 3 112 1.7 17 113 4.9 49 114 0.3 3 115 0.04 0 117 0.2 2 119 0.6 6 121 0.6 6 122 0.02 0 123 0.4 4 125 1.5 15 126 1.7 17 127 0.32 3 128 0.1 1 129 0.6 6 130 0.5 5 131 0.01 0 132 0.5 5 133 0.7 7 134 0.1 1 135 0.18 2 136 0.1 1 137 0.7 7 139 0.5 5 158 0.13 1 141 3.3 33 142 0.4 4 143 0.6 6 145 0.1 1 147 1.8 18 148 0.5 5 149 4.4 44 150 0.13 1 151 0.6 6 152 0.4 4 153 1 10 154 0.12 1 155 2.6 26 156 0.6 6 157 0.5 5 159 0.03 0 161 0.4 4 165 0.6 6 167 0.2 2 168 0.08 1 169 1.7 17 170 0.5 5 175 0.3 3 176 0.04 0 179 0.1 1 180 0.2 2 181 0.1 1 182 0.06 1 183 1.6 16 184 0.5 5 185 0.4 4 190 0.03 0 191 0.2 2 192 0.1 1 195 0.2 2 196 0.05 1 197 3.1 31 198 0.4 4 199 0.3 3 203 0.04 0 206 0.1 1 207 0.3 3 208 0.5 5 209 0.2 2 210 0.3 3 213 0.4 4 215 0.4 4 216 0.03 0 217 0.2 2 219 0.1 1 221 0.3 3 222 0.03 0 224 0.5 5 225 1.2 12 236 0.3 3 238 0.04 0 239 0.6 6 247 0.4 4 249 0.5 5 250 0.03 0 251 0.3 3 252 0.1 1 253 0.6 6 254 0.01 0 255 0.4 4 256 0.3 3 259 0.6 6 260 0.03 0 265 0.2 2 266 0.3 3 267 0.3 3 268 0.03 0 270 0.4 4 280 0.4 4 281 0.3 3 283 0.01 0 295 0.6 6 309 0.7 7 313 0.2 2 314 0.05 1 316 0.6 6 318 0.3 3 323 0.4 4 327 0.05 1 329 0.2 2 337 0.3 3 352 0.6 6 343 0.04 0 355 1.3 13 365 0.3 3 368 0.4 4 373 0.01 0 375 0.3 3 379 0.4 4 391 0.5 5 393 0.06 1 408 0.3 3 422 0.5 5 //