MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004012
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004012
RECORD_TITLE: PARA-ETHOXYPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: PARA-ETHOXYPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O2
CH$EXACT_MASS: 138.06808
CH$SMILES: CCOc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C8H10O2/c1-2-10-8-5-3-7(9)4-6-8/h3-6,9H,2H2,1H3
CH$LINK: INCHIKEY
LKVFCSWBKOVHAH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3044251
AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-03di-3900000000-84bcb341de72d774abca
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
28 1.8 18
29 5 50
43 4.5 45
51 0.18 2
53 8.6 86
54 4 40
55 3.4 34
56 0.3 3
63 2.1 21
64 1.4 14
65 3.3 33
66 0.63 6
79 4 40
81 14.7 147
82 7.7 77
93 0.2 2
94 6.1 61
110 99.99 999
111 7.4 74
121 0.15 2
138 47 470
139 4 40
//
system version 2.2.6-SNAPSHOT