MassBank Record: JP002983



 METHYL-TRANS-9-DODECENOATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002983
RECORD_TITLE: METHYL-TRANS-9-DODECENOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: METHYL-TRANS-9-DODECENOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H24O2 CH$EXACT_MASS: 212.17763 CH$SMILES: CCC=CCCCCCCCC(=O)OC CH$IUPAC: InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h4-5H,3,6-12H2,1-2H3/b5-4+
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9000000000-bf31ce96ae1beb7d708e PK$NUM_PEAK: 34 PK$PEAK: m/z int. rel.int. 41 99.99 999 42 18.4 184 43 47.7 477 44 1.08 11 45 8.6 86 53 12.2 122 54 14.2 142 55 8.62 86 56 15 150 57 16.4 164 59 26.1 261 67 2.59 26 68 19.5 195 69 50 500 70 10.2 102 71 1.29 13 74 59 590 75 9.7 97 81 19 190 82 1.43 14 83 28.5 285 84 22.9 229 85 10.2 102 87 1.09 11 95 13.6 136 96 26.2 262 97 23.8 238 98 1.69 17 110 10.9 109 111 9.5 95 138 12.3 123 163 0.61 6 180 10.3 103 212 7.3 73 //