MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008590
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008590
RECORD_TITLE: ETHYLENE GLYCOL MONO-PARA-TOLYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: ETHYLENE GLYCOL MONO-PARA-TOLYL ETHER
CH$NAME: 2-(PARA-METHYLPHENOXY)ETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H12O2
CH$EXACT_MASS: 152.08373
CH$SMILES: OCCOc(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C9H12O2/c1-8-2-4-9(5-3-8)11-7-6-10/h2-5,10H,6-7H2,1H3
CH$LINK: INCHIKEY
FFWXHQFJNOGDJE-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9065861
AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-6900000000-3d9fd380d648a1ac2172
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
15 1.33 13
19 1.42 14
27 9.05 91
29 3.91 39
31 6.03 60
39 8.12 81
41 1.54 15
43 2.81 28
45 11.53 115
50 3 30
51 8.44 84
52 3.81 38
53 3.95 40
62 1.21 12
63 4.85 49
64 1.24 12
65 11.98 120
77 13.9 139
78 4.06 41
79 9.25 93
80 6.73 67
89 2.9 29
90 7.03 70
91 23.25 233
92 1.66 17
93 2.03 20
107 48.36 484
108 99.99 999
109 11.26 113
121 4.34 43
152 39.61 396
153 3.06 31
//