MassBank Record: JP003379



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

ACCESSION: JP003379
RECORD_TITLE: DIBUTYL TARTRATE; 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$NAME: DIBUTYL TARTRATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H22O6 CH$EXACT_MASS: 262.14164 CH$SMILES: CCCCOC(=O)C(O)C(O)C(=O)OCCCC CH$IUPAC: InChI=1S/C12H22O6/c1-3-5-7-17-11(15)9(13)10(14)12(16)18-8-6-4-2/h9-10,13-14H,3-8H2,1-2H3
AC$INSTRUMENT: JEOL JMS-01-SG-2 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-9200000000-55a28e387acb5f12b83b PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 43 13 130 44 7.2 72 45 2.8 28 49 2.1 21 50 2.2 22 51 2.2 22 53 4.1 41 54 2.37 24 55 64.9 649 56 94.6 946 57 5.4 54 58 0.46 5 59 13.8 138 60 2.7 27 71 5.1 51 76 99.99 999 77 22.3 223 87 2.4 24 89 9 90 101 0.36 4 105 87.2 872 106 3.1 31 131 2.1 21 132 9.17 92 133 6 60 143 2.3 23 151 3.4 34 161 2.34 23 263 10.7 107 //