MassBank Record: JP002528



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

ACCESSION: JP002528
RECORD_TITLE: OLEYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: OLEYL ACETATE CH$NAME: CIS-9-OCTADECENYL ACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C20H38O2 CH$EXACT_MASS: 310.28718 CH$SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC CH$IUPAC: InChI=1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h11-12H,3-10,13-19H2,1-2H3/b12-11-
AC$INSTRUMENT: HITACHI RMU-6M 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: splash10-05o4-9100000000-a451572fc0202f2eb2cd PK$NUM_PEAK: 81 PK$PEAK: m/z int. rel.int. 15 3.83 38 27 11.18 112 28 2.78 28 29 29 290 31 1.34 13 39 8.96 90 40 2.19 22 41 74.93 749 42 14.29 143 43 92.8 928 44 2.98 30 53 7.29 73 54 45.15 452 55 99.99 999 56 25.41 254 57 34.69 347 58 1.57 16 61 21.17 212 65 1.67 17 66 6.4 64 67 64.93 649 68 47.22 472 69 62.18 622 70 17.19 172 71 11.62 116 73 2.96 30 77 2.02 20 79 7.23 72 80 7.14 71 81 57.54 575 82 91.28 913 83 50.56 506 84 10.52 105 85 5.54 55 91 1.96 20 93 2.75 28 94 3.64 36 95 47.23 472 96 71.72 717 97 32.48 325 98 6.12 61 99 1.35 14 105 1.07 11 107 1.21 12 108 2 20 109 30.4 304 110 33.04 330 111 13.39 134 112 3.44 34 116 1.02 10 121 1.27 13 122 1.63 16 123 15.29 153 124 20.18 202 125 6.25 63 126 2.42 24 137 9.15 92 138 12.14 121 139 2.87 29 140 1.73 17 151 3.9 39 152 6.5 65 153 1.67 17 154 1.19 12 165 2.25 23 166 4.39 44 167 1.5 15 168 1.52 15 179 1.6 16 180 2.83 28 193 1.59 16 194 3.1 31 196 1.54 15 208 1.86 19 222 5.75 58 223 1.19 12 224 2.21 22 236 1.34 13 250 19.07 191 251 4.02 40 310 0.5 5 //