MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002294
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002294
RECORD_TITLE: PARA-ANISIDINE; 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$NAME: PARA-ANISIDINE
CH$NAME: 4-METHOXYANILINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H9NO
CH$EXACT_MASS: 123.06841
CH$SMILES: COc(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C7H9NO/c1-9-7-4-2-6(8)3-5-7/h2-5H,8H2,1H3
CH$LINK: INCHIKEY
BHAAPTBBJKJZER-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7024532
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-0ab9-5900000000-3786160ae4a86463960a
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
42 1.29 13
47 1.84 18
50 3.03 30
51 5.14 51
52 17.09 171
53 20.29 203
54 4.62 46
61 4.9 49
62 2.16 22
63 4.58 46
64 3.57 36
65 9.71 97
66 2.3 23
67 1.12 11
77 2.59 26
78 1.75 18
79 3.52 35
80 32.08 321
81 2.88 29
91 1.02 10
92 4.68 47
95 2.81 28
106 1.17 12
107 7.6 76
108 99.99 999
109 8.61 86
120 7.38 74
122 3.57 36
123 76.39 764
124 6.72 67
//
system version 2.2.8-SNAPSHOT