MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008926
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008926
RECORD_TITLE: ETHYLENE GLYCOL MONOHEXYL 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$NAME: ETHYLENE GLYCOL MONOHEXYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H18O2
CH$EXACT_MASS: 146.13068
CH$SMILES: CCCCCCOCCO
CH$IUPAC: InChI=1S/C8H18O2/c1-2-3-4-5-7-10-8-6-9/h9H,2-8H2,1H3
CH$LINK: INCHIKEY
UPGSWASWQBLSKZ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1026908
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$SPLASH: splash10-000f-9000000000-2c1b1e0612a3f6f8e71b
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
27 1 10
28 1.8 18
29 3 30
31 0.16 2
41 8.3 83
42 4.3 43
43 99.99 999
44 0.37 4
45 33.1 331
46 1.4 14
55 10.3 103
56 2.07 21
57 17 170
58 1 10
59 1 10
63 2.21 22
69 4.9 49
70 1 10
71 4.7 47
72 0.12 1
75 11.4 114
82 1.2 12
83 22.5 225
84 1.68 17
85 74.6 746
86 5.7 57
99 2.4 24
101 0.12 1
115 9.1 91
117 1 10
//