MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009215
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009215
RECORD_TITLE: M-ETHYLPHENOL; 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$NAME: M-ETHYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O
CH$EXACT_MASS: 122.07316
CH$SMILES: CCc(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C8H10O/c1-2-7-4-3-5-8(9)6-7/h3-6,9H,2H2,1H3
CH$LINK: INCHIKEY
HMNKTRSOROOSPP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0022480
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$SPLASH: splash10-0ab9-5900000000-878073166afeb89cd11c
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
15 1.05 11
27 5.41 54
29 1.05 11
38 2.2 22
39 11.58 116
40 1.26 13
41 2.06 21
50 2.62 26
51 6.86 69
52 2.43 24
53 4.35 44
55 2.1 21
60 1.17 12
62 1.58 16
63 4.45 45
64 1.23 12
65 5.98 60
66 2.06 21
77 22.27 223
78 4.05 41
79 6.38 64
81 1.03 10
91 6.81 68
93 1.57 16
94 8.34 83
95 1.32 13
103 2.67 27
105 1.29 13
107 99.99 999
108 8.1 81
121 4.83 48
122 52.37 524
123 3.93 39
//
system version 2.2.6-SNAPSHOT