MassBank Record: JP009317



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

ACCESSION: JP009317
RECORD_TITLE: DIETHYLENE GLYCOL DIBUTYL ETHER; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: YAMAMOTO MDEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV., DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: DIETHYLENE GLYCOL DIBUTYL ETHER CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H26O3 CH$EXACT_MASS: 218.18819 CH$SMILES: CCCCOCCOCCOCCCC CH$IUPAC: InChI=1S/C12H26O3/c1-3-5-7-13-9-11-15-12-10-14-8-6-4-2/h3-12H2,1-2H3 CH$LINK: INCHIKEY KZVBBTZJMSWGTK-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6M AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-9100000000-faa1409377d1d21d90b0 PK$NUM_PEAK: 42 PK$PEAK: m/z int. rel.int. 29 6.1 61 41 12 120 42 1.3 13 43 0.26 3 44 5.9 59 45 47.5 475 46 1.3 13 55 0.48 5 56 54 540 57 99.99 999 58 4.6 46 59 2.12 21 60 1.3 13 61 1.5 15 63 2 20 69 0.28 3 71 8.3 83 72 14.2 142 73 6.1 61 74 0.11 1 75 34.4 344 76 1.5 15 82 1.3 13 83 0.22 2 85 30.6 306 86 2.4 24 87 14.2 142 88 0.2 2 89 6.8 68 98 1.1 11 99 1.8 18 100 3.28 33 101 22.1 221 102 1.8 18 103 4.4 44 116 0.31 3 117 5.9 59 118 2.4 24 131 8.1 81 132 0.11 1 144 8.1 81 145 1.5 15 //