MassBank Record: JP001763



 1,2-BENZENEDICARBOXYLIC ACID DECYL METHYLESTER; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001763
RECORD_TITLE: 1,2-BENZENEDICARBOXYLIC ACID DECYL METHYLESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 1,2-BENZENEDICARBOXYLIC ACID DECYL METHYLESTER CH$NAME: METHYLDECYL PHTHALATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C19H28O4 CH$EXACT_MASS: 320.19876 CH$SMILES: CCCCCCCCCCOC(=O)c(c1)c(ccc1)C(=O)OC CH$IUPAC: InChI=1S/C19H28O4/c1-3-4-5-6-7-8-9-12-15-23-19(21)17-14-11-10-13-16(17)18(20)22-2/h10-11,13-14H,3-9,12,15H2,1-2H3
AC$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$SPLASH: splash10-03dj-1900000000-0096cac668a4cd23ae06 PK$NUM_PEAK: 38 PK$PEAK: m/z int. rel.int. 27 0.18 2 28 3.04 30 29 0.57 6 43 1.08 11 55 4.93 49 56 5.85 59 57 3.73 37 68 0.56 6 69 4.15 42 70 5.68 57 71 2.01 20 77 1.58 16 82 0.6 6 83 3.26 33 84 2.24 22 85 1.1 11 91 0.48 5 92 1.87 19 97 1.79 18 98 1 10 104 0.76 8 105 1.62 16 111 0.67 7 112 0.98 10 132 0.28 3 133 0.62 6 135 2.29 23 136 2.11 21 140 0.72 7 149 89.16 892 150 7.73 77 151 0.77 8 163 99.99 999 164 11.17 112 165 0.98 10 181 28.23 282 182 2.14 21 208 0.11 1 //