MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006073
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006073
RECORD_TITLE: TRIETHYLENE GLYCOL DIMETHYL 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$NAME: TRIETHYLENE GLYCOL DIMETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H18O4
CH$EXACT_MASS: 178.12051
CH$SMILES: COCCOCCOCCOC
CH$IUPAC: InChI=1S/C8H18O4/c1-9-3-5-11-7-8-12-6-4-10-2/h3-8H2,1-2H3
CH$LINK: INCHIKEY
YFNKIDBQEZZDLK-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8026224
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$SPLASH: splash10-0a4i-9100000000-475d0f859a4c432162ca
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
29 1.87 19
31 2.51 25
43 1 10
45 5.62 56
58 38.16 382
59 99.99 999
60 3.55 36
73 1.14 11
87 10.64 106
88 1.72 17
89 13.75 138
90 1.04 10
101 1.52 15
102 4.98 50
103 19.96 200
104 1.16 12
119 1 10
133 8.39 84
178 0.22 2
//
system version 2.2.8-SNAPSHOT