MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004155
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004155
RECORD_TITLE: N-DODECYL-N-METHYLPROPIONAMIDE; 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$NAME: N-DODECYL-N-METHYLPROPIONAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H33NO
CH$EXACT_MASS: 255.25621
CH$SMILES: CCCCCCCCCCCCN(C)C(=O)CC
CH$IUPAC: InChI=1S/C16H33NO/c1-4-6-7-8-9-10-11-12-13-14-15-17(3)16(18)5-2/h4-15H2,1-3H3
CH$LINK: INCHIKEY
GQQHNTXKLBDYQN-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:101621131
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$SPLASH: splash10-0006-9320000000-0212c2195961e40c74b0
PK$NUM_PEAK: 97
PK$PEAK: m/z int. rel.int.
26 0.3 3
27 4 40
28 2.4 24
29 1.88 19
30 2.5 25
31 0.2 2
32 1.3 13
39 0.19 2
40 0.5 5
41 13 130
42 7 70
43 1.26 13
44 99.99 999
45 4.4 44
46 0.2 2
51 0.01 0
52 0.1 1
53 0.8 8
54 0.6 6
55 0.82 8
56 2.6 26
57 19.6 196
58 9.4 94
59 0.09 1
60 0.1 1
65 0.2 2
66 0.1 1
67 0.08 1
68 0.6 6
69 2.7 27
70 2.9 29
71 0.19 2
72 1.3 13
73 0.3 3
74 0.1 1
77 0.02 0
78 0.1 1
79 0.2 2
80 0.1 1
81 0.03 0
82 0.2 2
83 0.7 7
84 1 10
85 0.07 1
86 1.5 15
87 5.2 52
88 5.6 56
89 0.03 0
95 0.1 1
96 0.1 1
97 0.3 3
98 0.08 1
99 0.2 2
100 33 330
101 22.4 224
102 0.16 2
103 0.1 1
111 0.1 1
112 0.4 4
113 0.03 0
114 8.4 84
115 2.5 25
116 0.2 2
126 0.03 0
127 0.1 1
128 6.2 62
129 1.8 18
130 0.02 0
140 0.2 2
141 0.2 2
142 3.3 33
143 0.04 0
154 0.1 1
155 0.1 1
156 2.2 22
157 0.04 0
169 0.1 1
170 2.8 28
171 0.4 4
184 0.22 2
185 0.4 4
196 0.1 1
197 0.1 1
198 0.37 4
199 0.8 8
200 0.3 3
212 1 10
213 0.02 0
226 40 400
227 6.4 64
228 0.5 5
240 0.06 1
241 0.1 1
254 0.6 6
255 5.8 58
256 0.11 1
257 0.2 2
//