MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004190
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004190
RECORD_TITLE: N-DODECYL-4-HYDROXYBUTYRAMIDE; 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$NAME: N-DODECYL-4-HYDROXYBUTYRAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H33NO2
CH$EXACT_MASS: 271.25113
CH$SMILES: CCCCCCCCCCCCNC(=O)CCCO
CH$IUPAC: InChI=1S/C16H33NO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-16(19)13-12-15-18/h18H,2-15H2,1H3,(H,17,19)
CH$LINK: INCHIKEY
XDLZKXFUWLXBCL-UHFFFAOYSA-N
AC$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: splash10-0016-9420000000-13b13c0fb4e59a5e806b
PK$NUM_PEAK: 213
PK$PEAK: m/z int. rel.int.
26 1.3 13
27 9 90
28 28.6 286
29 2 20
30 99.99 999
31 18 180
32 5.8 58
33 0.01 0
34 0.2 2
35 0.1 1
36 0.1 1
37 0.01 0
38 0.3 3
39 5.6 56
40 1.2 12
41 4.7 47
42 12 120
43 47.4 474
44 31.8 318
45 1 10
46 0.5 5
50 0.2 2
51 0.4 4
52 0.05 1
53 2 20
54 3 30
55 29 290
56 1.16 12
57 22 220
58 14 140
59 7.2 72
60 0.6 6
61 0.2 2
62 0.1 1
63 0.2 2
64 0.02 0
65 0.6 6
66 0.4 4
67 3.5 35
68 0.26 3
69 22.4 224
70 7.6 76
71 9 90
72 1.32 13
73 28 280
74 2.7 27
75 0.2 2
76 0.06 1
77 0.7 7
78 0.3 3
79 0.9 9
80 0.05 1
81 1.8 18
82 1.5 15
83 5.8 58
84 0.44 4
85 7 70
86 31.4 314
87 48 480
88 0.27 3
89 0.5 5
91 0.6 6
92 0.2 2
93 0.03 0
94 0.4 4
95 1.1 11
96 1.2 12
97 0.36 4
98 17.6 176
99 17 170
100 20 200
101 1.4 14
102 1.5 15
103 0.3 3
104 1.4 14
105 0.04 0
106 0.2 2
107 1.3 13
108 0.6 6
109 0.05 1
110 0.7 7
111 1.4 14
112 7.4 74
113 0.44 4
114 20 200
115 6 60
116 5 50
117 4.74 47
118 3.4 34
119 0.6 6
120 0.2 2
121 0.03 0
122 0.2 2
123 0.3 3
124 0.6 6
125 0.05 1
126 11.4 114
127 2.3 23
128 12.6 126
129 0.31 3
130 18 180
131 6.2 62
132 0.5 5
133 0.04 0
134 0.2 2
135 0.2 2
136 0.2 2
137 0.03 0
138 0.4 4
139 0.1 1
140 5 50
141 0.19 2
142 9.2 92
143 2.4 24
144 26 260
145 0.72 7
146 0.7 7
147 0.2 2
148 0.3 3
149 0.06 1
150 0.1 1
151 0.2 2
152 0.3 3
153 0.03 0
154 5.4 54
155 1.3 13
156 7.2 72
157 0.22 2
158 16.2 162
159 5.2 52
160 0.5 5
161 0.01 0
162 0.2 2
163 0.5 5
164 0.1 1
165 0.01 0
166 0.2 2
167 0.2 2
168 3.6 36
169 0.08 1
170 6 60
171 1.6 16
172 11.6 116
173 0.5 5
174 0.6 6
175 0.1 1
180 0.2 2
181 0.02 0
182 2.8 28
183 0.7 7
184 9.2 92
185 0.24 2
186 11.8 118
187 3.2 32
188 0.4 4
189 0.02 0
190 0.1 1
191 0.1 1
195 0.1 1
196 0.23 2
197 0.7 7
198 3.6 36
199 0.9 9
200 1.24 12
201 3.3 33
202 0.3 3
203 0.1 1
207 0.02 0
208 0.1 1
209 0.1 1
210 2.2 22
211 0.05 1
212 18 180
213 2.6 26
214 9 90
215 0.29 3
216 0.5 5
217 0.2 2
218 0.2 2
219 0.02 0
220 0.1 1
222 0.1 1
223 0.1 1
224 0.16 2
225 0.4 4
226 0.7 7
227 16.8 168
228 0.88 9
229 2.8 28
230 0.4 4
237 0.3 3
238 0.07 1
239 0.2 2
240 24 240
241 7 70
242 0.68 7
243 1.1 11
244 0.3 3
252 1.5 15
253 0.26 3
254 1.3 13
255 0.6 6
256 2.2 22
257 0.04 0
258 0.1 1
267 0.2 2
268 0.6 6
269 0.03 0
270 2.4 24
271 21 210
272 6 60
273 0.08 1
274 0.1 1
//