MassBank Record: JP001739



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

ACCESSION: JP001739
RECORD_TITLE: HEXANEDIOIC ACID DIHEXYL ESTER; 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$NAME: HEXANEDIOIC ACID DIHEXYL ESTER CH$NAME: DIHEXYL ADIPATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H34O4 CH$EXACT_MASS: 314.24571 CH$SMILES: CCCCCCOC(=O)CCCCC(=O)OCCCCCC CH$IUPAC: InChI=1S/C18H34O4/c1-3-5-7-11-15-21-17(19)13-9-10-14-18(20)22-16-12-8-6-4-2/h3-16H2,1-2H3
AC$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$SPLASH: splash10-01t9-9820000000-a4e40748f43f6c49311b PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 28 1.96 20 40 6.38 64 42 9.63 96 43 47.11 471 69 16.37 164 70 6.41 64 71 4.38 44 82 7.66 77 83 14.7 147 84 18.21 182 85 14.26 143 87 28.74 287 97 8.14 81 98 2.9 29 100 11.46 115 101 11.99 120 111 25.93 259 112 5.51 55 128 3.13 31 129 99.99 999 130 6.22 62 171 2.23 22 184 11.57 116 213 53.11 531 214 6.28 63 231 1.67 17 //