MassBank Record: JP010478



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

ACCESSION: JP010478
RECORD_TITLE: 1,1,1-TRIETHOXYETHANE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: TAJIMA SGUNMA COLLEGE OF TECHNOLOGY, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: 1,1,1-TRIETHOXYETHANE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H18O3 CH$EXACT_MASS: 162.12559 CH$SMILES: CCOC(C)(OCC)OCC CH$IUPAC: InChI=1S/C8H18O3/c1-5-9-8(4,10-6-2)11-7-3/h5-7H2,1-4H3 CH$LINK: INCHIKEY NDQXKKFRNOPRDW-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80A 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: splash10-01r6-9100000000-1bbab8b7e4264ed57c95 PK$NUM_PEAK: 32 PK$PEAK: m/z int. rel.int. 19 1.47 15 26 7.62 76 27 35.14 351 28 5.71 57 29 56.7 567 30 4.98 50 31 19.48 195 39 1.09 11 41 2.4 24 42 23.63 236 43 99.99 999 44 3.6 36 45 16.81 168 46 2.25 23 47 2.61 26 59 1.15 12 60 15.66 157 61 96.49 965 62 2.36 24 63 6.26 63 70 1.25 13 73 1.57 16 75 1.31 13 87 1.07 11 89 27.6 276 90 1.35 14 91 3.22 32 116 3.93 39 117 55.86 559 118 3.91 39 119 1.37 14 147 4.97 50 //