MassBank Record: JP002651



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

ACCESSION: JP002651
RECORD_TITLE: 2-HEXYLDECANOIC 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$NAME: 2-HEXYLDECANOIC ACID METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H34O2 CH$EXACT_MASS: 270.25588 CH$SMILES: CCCCCCCCC(CCCCCC)C(=O)OC CH$IUPAC: InChI=1S/C17H34O2/c1-4-6-8-10-11-13-15-16(17(18)19-3)14-12-9-7-5-2/h16H,4-15H2,1-3H3
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$SPLASH: splash10-052r-9500000000-5c33e3d5921c1708fbb9 PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 41 9.9 99 55 47.1 471 57 24.7 247 59 0.79 8 67 5.2 52 69 27.5 275 71 15.1 151 74 1.7 17 83 13.7 137 85 6.6 66 87 99.99 999 88 0.82 8 97 7.7 77 98 4.9 49 101 27.2 272 115 3.38 34 129 20.1 201 143 31.9 319 157 14.3 143 158 2.03 20 159 6.8 68 171 18.4 184 185 6.8 68 186 4.46 45 187 5.7 57 199 14.8 148 270 4.6 46 //