MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004176
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004176
RECORD_TITLE: N-(4-ETHOXYPHENYL)-2-PYRROLIDONE; 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$NAME: N-(4-ETHOXYPHENYL)-2-PYRROLIDONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H15NO2
CH$EXACT_MASS: 205.11028
CH$SMILES: CCOc(c2)ccc(c2)N(C1)C(=O)CC1
CH$IUPAC: InChI=1S/C12H15NO2/c1-2-15-11-7-5-10(6-8-11)13-9-3-4-12(13)14/h5-8H,2-4,9H2,1H3
CH$LINK: INCHIKEY
TWVVNUHXQJVIEC-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6E
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: splash10-0adi-5940000000-2753b40cda2a48b522e8
PK$NUM_PEAK: 129
PK$PEAK: m/z int. rel.int.
26 1.5 15
27 7.8 78
28 7 70
29 0.68 7
30 1.1 11
31 0.3 3
32 0.4 4
37 0.03 0
38 1.9 19
39 12 120
40 1.8 18
41 2 20
42 4.5 45
43 1.4 14
44 0.2 2
45 0.01 0
50 2.3 23
51 4.1 41
52 5 50
53 0.3 3
54 1.3 13
55 5.4 54
56 0.7 7
57 0.05 1
59 0.2 2
60 0.4 4
61 0.2 2
62 0.11 1
63 5.6 56
64 6 60
65 13 130
66 0.42 4
67 2 20
68 0.9 9
69 34.4 344
70 0.15 2
71 0.4 4
72 0.1 1
73 0.2 2
74 0.06 1
75 1 10
76 2 20
77 5.4 54
78 0.33 3
79 2.2 22
80 2.1 21
81 1.4 14
82 0.03 0
83 0.3 3
84 0.7 7
85 0.2 2
86 0.04 0
87 0.3 3
88 0.2 2
89 0.6 6
90 0.21 2
91 3.7 37
92 5.2 52
93 6.8 68
94 0.35 4
95 0.8 8
97 0.2 2
98 0.3 3
99 0.04 0
102 0.6 6
103 0.9 9
104 2.1 21
105 0.46 5
106 2.1 21
107 2.8 28
108 4.2 42
109 0.09 1
110 0.3 3
115 0.5 5
116 0.5 5
117 0.12 1
118 1.6 16
119 2.3 23
120 12 120
121 0.7 7
122 77 770
123 7.4 74
124 0.4 4
125 0.02 0
126 0.1 1
130 0.7 7
131 0.6 6
132 0.13 1
133 1.9 19
134 1.7 17
135 3.4 34
136 0.05 1
137 0.4 4
141 1.3 13
142 0.3 3
145 0.02 0
146 1.4 14
147 0.6 6
148 6.6 66
149 0.35 4
150 39 390
151 3.8 38
152 0.7 7
155 0.07 1
156 0.2 2
159 0.2 2
160 0.8 8
161 0.04 0
162 0.4 4
163 0.7 7
165 0.2 2
166 0.04 0
167 0.2 2
168 0.2 2
169 0.4 4
170 0.02 0
174 0.4 4
175 0.4 4
176 67.6 676
177 2.5 25
178 2.8 28
179 0.2 2
180 0.1 1
203 0.02 0
204 1.4 14
205 99.99 999
206 14 140
207 0.11 1
208 0.2 2
//
system version 2.2.8-SNAPSHOT