MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006162
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006162
RECORD_TITLE: ETHYLENE GLYCOL MONO-TERT-BUTYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: ETHYLENE GLYCOL MONO-TERT-BUTYL ETHER
CH$NAME: 2-TERT-BUTOXYETHANOL
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 M-80
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-9000000000-f737e2beaa157d45747a
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
18 1.25 13
27 1.84 18
29 23.88 239
31 7.93 79
41 30.7 307
42 1.44 14
43 2.57 26
45 18.75 188
55 1.83 18
56 11.75 118
57 99.99 999
58 4.83 48
59 65.01 650
60 1.93 19
87 2.86 29
103 12.27 123
118 0.24 2
//