MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006075
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006075
RECORD_TITLE: TRIETHYLENE GLYCOL MONOETHYL 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$NAME: TRIETHYLENE GLYCOL MONOETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H18O4
CH$EXACT_MASS: 178.12051
CH$SMILES: CCOCCOCCOCCO
CH$IUPAC: InChI=1S/C8H18O4/c1-2-10-5-6-12-8-7-11-4-3-9/h9H,2-8H2,1H3
CH$LINK: INCHIKEY
WFSMVVDJSNMRAR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3024368
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$SPLASH: splash10-00ds-9100000000-6aac59cbc8247695b5fb
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
29 1.02 10
43 3.11 31
44 8.22 82
45 99.99 999
58 5.95 60
59 43.18 432
60 2.7 27
72 70.61 706
73 53.08 531
74 2.2 22
75 7.51 75
76 3.26 33
87 10.5 105
88 17.1 171
89 52.3 523
90 2.6 26
101 5.88 59
102 2.81 28
103 21.29 213
104 1.55 16
116 7.54 75
117 5.2 52
119 7.32 73
178 0.86 9
//