MassBank Record: JP002654



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

ACCESSION: JP002654
RECORD_TITLE: 2-HEXADECENOIC ACID METHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: 2-HEXADECENOIC ACID METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H32O2 CH$EXACT_MASS: 268.24023 CH$SMILES: CCCCCCCCCCCCCC=CC(=O)OC CH$IUPAC: InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h15-16H,3-14H2,1-2H3/b16-15+
AC$INSTRUMENT: JEOL JMS-01-SG AC$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$SPLASH: splash10-001a-9200000000-215b78e5e80397091531 PK$NUM_PEAK: 35 PK$PEAK: m/z int. rel.int. 41 14.2 142 53 10.1 101 54 10.3 103 55 5.76 58 56 18 180 57 39.3 393 59 16.3 163 67 2.07 21 68 20.2 202 69 33.6 336 70 12.5 125 71 1.72 17 74 37.1 371 81 32.2 322 82 16.6 166 83 2.92 29 84 28.9 289 85 20.3 203 87 99.99 999 95 1.99 20 96 26.5 265 97 26.7 267 98 22.9 229 100 1.5 15 101 16.6 166 109 11.4 114 110 12.8 128 111 1.33 13 113 36.3 363 127 9 90 141 11.7 117 152 0.9 9 194 9.8 98 236 9.8 98 237 10.3 103 //