MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008226
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008226
RECORD_TITLE: PENTADECANAL; 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$NAME: PENTADECANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H30O
CH$EXACT_MASS: 226.22967
CH$SMILES: CCCCCCCCCCCCCCC=O
CH$IUPAC: InChI=1S/C15H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h15H,2-14H2,1H3
CH$LINK: INCHIKEY
XGQJZNCFDLXSIJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5062633
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$SPLASH: splash10-05uu-9000000000-b2ee652bfbf3222f20b9
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
41 14.75 148
42 8.19 82
43 74.75 748
44 43.61 436
45 19.02 190
54 12.95 130
55 33.11 331
56 24.59 246
57 77.38 774
58 4.26 43
66 10.82 108
67 37.7 377
68 62.3 623
69 30.49 305
70 22.95 230
71 37.05 371
72 41.67 417
80 2.62 26
81 29.51 295
82 99.99 999
83 34.43 344
84 11.48 115
85 14.75 148
86 2.95 30
94 2.62 26
95 29.51 295
96 44.26 443
97 23.93 239
98 6.56 66
100 2.3 23
108 11.48 115
110 11.48 115
111 5.9 59
112 5.57 56
114 3.28 33
119 0.98 10
123 3.93 39
124 8.2 82
125 4.92 49
126 3.61 36
137 3.28 33
138 4.92 49
151 1.64 16
152 3.28 33
166 1.64 16
167 1.64 16
169 2.62 26
175 0.66 7
178 0.98 10
180 3.28 33
182 3.61 36
208 3.28 33
//
system version 2.2.8-SNAPSHOT