MassBank Record: JP002165



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

ACCESSION: JP002165
RECORD_TITLE: 13-METHYLTETRADECANOIC 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$NAME: 13-METHYLTETRADECANOIC ACID METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H32O2 CH$EXACT_MASS: 256.24023 CH$SMILES: COC(=O)CCCCCCCCCCCC(C)C CH$IUPAC: InChI=1S/C16H32O2/c1-15(2)13-11-9-7-5-4-6-8-10-12-14-16(17)18-3/h15H,4-14H2,1-3H3
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$SPLASH: splash10-00dr-9100000000-bc9efe344475c8bedff2 PK$NUM_PEAK: 38 PK$PEAK: m/z int. rel.int. 43 1.3 13 44 1.3 13 55 20 200 56 0.4 4 57 12.4 124 59 4.8 48 65 1.3 13 67 0.35 4 69 14 140 70 1.6 16 71 2.7 27 74 99.99 999 75 12.7 127 81 3.5 35 83 8.6 86 84 0.24 2 87 52.1 521 88 5.1 51 95 1.6 16 97 0.64 6 101 7 70 102 1.6 16 107 1.8 18 111 0.37 4 125 1.6 16 129 4.5 45 143 14.5 145 144 0.24 2 157 5.6 56 171 2.9 29 185 2.7 27 199 0.45 5 213 11.3 113 214 1.8 18 225 1.8 18 227 0.18 2 256 5.4 54 257 1.3 13 //