MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008225
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008225
RECORD_TITLE: TETRADECANAL; 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$NAME: TETRADECANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H28O
CH$EXACT_MASS: 212.21402
CH$SMILES: CCCCCCCCCCCCCC=O
CH$IUPAC: InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3
CH$LINK: INCHIKEY
UHUFTBALEZWWIH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1021665
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-01c4-9300000000-179d554bb2fae7fd5ffd
PK$NUM_PEAK: 57
PK$PEAK: m/z int. rel.int.
41 12.79 128
42 9.84 98
43 51.8 518
44 59.02 590
45 37.05 371
54 13.11 131
55 26.23 262
56 53.44 534
57 36.72 367
59 3.28 33
67 75.41 754
68 70.49 705
69 34.42 344
70 37.7 377
71 40.98 410
78 18.03 180
81 36.72 367
82 99.99 999
83 35.41 354
84 21.31 213
85 6.56 66
87 14.1 141
91 6.23 62
93 19.67 197
94 16.39 164
95 30.49 305
96 40.98 410
97 26.56 266
98 12.13 121
99 33.11 331
104 19.67 197
106 10.16 102
107 3.28 33
109 26.56 266
110 0.98 10
118 6.23 62
121 13.11 131
123 12.79 128
135 3.61 36
137 8.19 82
139 6.56 66
141 22.62 226
142 16.39 164
144 12.79 128
147 21.64 216
149 3.28 33
152 16.39 164
153 19.02 190
154 19.02 190
162 10.16 102
168 28.85 289
169 12.79 128
172 16.07 161
178 13.11 131
179 16.39 164
194 19.01 190
195 12.46 125
//