MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002125
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002125
RECORD_TITLE: PARA-ETHYL ANILINE; 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$NAME: PARA-ETHYL ANILINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H11N
CH$EXACT_MASS: 121.08915
CH$SMILES: CCc(c1)ccc(N)c1
CH$IUPAC: InChI=1S/C8H11N/c1-2-7-3-5-8(9)6-4-7/h3-6H,2,9H2,1H3
CH$LINK: INCHIKEY
HRXZRAXKKNUKRF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0022066
AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0a4i-3900000000-00d2642a2c01197ba178
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
27 1.04 10
28 8.59 86
39 3.46 35
41 1.38 14
44 1.94 19
51 2.28 23
52 2.07 21
53 4.36 44
58.5 2.63 26
59.5 1.24 12
63 1.11 11
65 3.46 35
77 11.27 113
78 2.84 28
79 6.64 66
91 3.25 33
93 2.07 21
103 1.31 13
104 1.11 11
106 99.99 999
107 10.44 104
118 2.56 26
119 2.63 26
120 4.15 42
121 34.16 342
122 3.39 34
//