MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011790
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011790
RECORD_TITLE: PARA-METHOXYPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: PARA-METHOXYPHENOL
CH$NAME: 4-METHOXYPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H8O2
CH$EXACT_MASS: 124.05243
CH$SMILES: COc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2-5,8H,1H3
CH$LINK: INCHIKEY
NWVVVBRKAWDGAB-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4020828
AC$INSTRUMENT: HITACHI M-80A
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: splash10-05fr-3900000000-5f100d415313d60a9ba0
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
26 1.03 10
27 1.98 20
29 1.43 14
38 1.41 14
39 4.48 45
41 1.12 11
50 2.14 21
51 3.12 31
52 3.77 38
53 11.79 118
54 3.31 33
55 2.67 27
64 1.41 14
65 4.32 43
80 1.19 12
81 34.47 345
82 2.57 26
93 1.51 15
95 1.93 19
109 90.07 901
110 6.04 60
123 2.39 24
124 99.99 999
125 8.01 80
//
system version 2.2.6-SNAPSHOT