MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008925
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008925
RECORD_TITLE: ETHYLENE GLYCOL MONO-TERT-BUTYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ETHYLENE GLYCOL MONO-TERT-BUTYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14O2
CH$EXACT_MASS: 118.09938
CH$SMILES: OCCOC(C)(C)C
CH$IUPAC: InChI=1S/C6H14O2/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3
CH$LINK: INCHIKEY
BDLXTDLGTWNUFM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4073384
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$SPLASH: splash10-0a4i-9100000000-6023c28a6889a8dd2679
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
28 1 10
29 8 80
31 2.6 26
41 1.66 17
45 13.1 131
55 1.3 13
56 10.5 105
57 99.99 999
58 4.4 44
59 68.4 684
60 2.3 23
87 0.55 6
88 1.8 18
103 28.2 282
104 1.7 17
//