MassBank Record: JP009019



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

ACCESSION: JP009019
RECORD_TITLE: DIBUTYL ADIPATE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: DIBUTYL ADIPATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H26O4 CH$EXACT_MASS: 258.18311 CH$SMILES: CCCCOC(=O)CCCCC(=O)OCCCC CH$IUPAC: InChI=1S/C14H26O4/c1-3-5-11-17-13(15)9-7-8-10-14(16)18-12-6-4-2/h3-12H2,1-2H3 CH$LINK: CAS 105-99-7 CH$LINK: INCHIKEY XTJFFFGAUHQWII-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80B AC$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$SPLASH: splash10-0570-9800000000-3b60744c05ba28ab9a9e PK$NUM_PEAK: 53 PK$PEAK: m/z int. rel.int. 26 1.44 14 27 19.1 191 28 13.74 137 29 55.97 560 30 1.4 14 31 2.86 29 39 11.45 115 40 1.96 20 41 61.23 612 42 9.52 95 43 18.97 190 44 1.71 17 45 3.45 35 53 2.34 23 54 3.33 33 55 58.88 589 56 49.31 493 57 42.57 426 58 2.44 24 59 8.72 87 60 8.28 83 61 3.02 30 68 1.88 19 69 3.36 34 73 11.04 110 74 1.61 16 82 1.41 14 83 19.96 200 84 7.75 78 85 1.83 18 87 34.3 343 88 1.47 15 99 2 20 100 25.87 259 101 35.84 358 102 4.99 50 103 1.5 15 110 1.86 19 111 54.01 540 112 8.44 84 128 3.02 30 129 98.7 987 130 6.94 69 143 26.84 268 144 1.94 19 156 27 270 157 3.41 34 158 2.53 25 184 1.75 18 185 99.99 999 186 10.48 105 187 1.27 13 203 2.02 20 //