MassBank Record: JP003384



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

ACCESSION: JP003384
RECORD_TITLE: DIETHYL ADIPATE; 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$NAME: DIETHYL ADIPATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H18O4 CH$EXACT_MASS: 202.12051 CH$SMILES: CCOC(=O)CCCCC(=O)OCC CH$IUPAC: InChI=1S/C10H18O4/c1-3-13-9(11)7-5-6-8-10(12)14-4-2/h3-8H2,1-2H3
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$SPLASH: splash10-0r29-5900000000-bde74dd7bba39ad4bcde PK$NUM_PEAK: 38 PK$PEAK: m/z int. rel.int. 44 23 230 46 12.7 127 53 3.3 33 54 62.3 623 55 13 130 56 4.5 45 58 11 110 59 1.52 15 60 7.7 77 68 2.6 26 69 4.5 45 70 0.68 7 73 25.3 253 74 3.8 38 82 2.5 25 83 2.11 21 84 6.3 63 87 8.9 89 88 14.8 148 99 0.29 3 100 6.7 67 101 27.7 277 102 3.6 36 110 0.34 3 111 66.7 667 112 6.9 69 114 5 50 115 4.83 48 116 3.4 34 128 60.2 602 129 14.2 142 130 0.25 3 143 7.1 71 156 18.4 184 157 99.99 999 158 0.92 9 202 4.7 47 203 12.8 128 //