MassBank Record: JP001289



 3,6,9-TRIOXADECANE-1-OL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001289
RECORD_TITLE: 3,6,9-TRIOXADECANE-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: 3,6,9-TRIOXADECANE-1-OL CH$NAME: TRIETHYLENE GLYCOL MONOMETHYL ETHER CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H16O4 CH$EXACT_MASS: 164.10486 CH$SMILES: COCCOCCOCCO CH$IUPAC: InChI=1S/C7H16O4/c1-9-4-5-11-7-6-10-3-2-8/h8H,2-7H2,1H3
AC$INSTRUMENT: HITACHI RMU-7M 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: splash10-0a4j-9000000000-562841fb0856c2a8cd69 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 15 9.44 94 19 3.25 33 26 1.27 13 27 7.94 79 28 8.57 86 29 24.21 242 30 1.83 18 31 26.59 266 33 1.19 12 41 1.43 14 42 1.19 12 43 10.48 105 44 9.6 96 45 99.99 999 46 2.3 23 57 1.59 16 58 33.02 330 59 79.37 794 60 3.57 36 73 1.19 12 75 3.17 32 87 4.21 42 88 3.17 32 89 16.75 168 90 1.19 12 101 1.19 12 102 2.22 22 103 3.1 31 119 2.06 21 //