MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008137
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008137
RECORD_TITLE: HEXACOSANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAOKA R, KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: HEXACOSANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C26H54
CH$EXACT_MASS: 366.42255
CH$SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C26H54/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-26H2,1-2H3
CH$LINK: INCHIKEY
HMSWAIKSFDFLKN-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7060883
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0a4l-9000000000-8ff648370df9ab839d2d
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
41 29.44 294
42 9.33 93
43 84.9 849
53 1.11 11
54 2.83 28
55 25.75 258
56 14.8 148
57 99.99 999
58 6.1 61
67 3.5 35
69 14.38 144
70 9.34 93
71 55.87 559
72 4.58 46
78 2.64 26
82 2.91 29
83 10.57 106
84 6.92 69
85 38.34 383
86 3.49 35
95 1.54 15
96 1.06 11
97 7.74 77
98 5.21 52
99 12.87 129
111 3.81 38
112 3.94 39
113 8.72 87
125 1.53 15
126 2.66 27
127 5.25 53
140 1.86 19
141 4.87 49
154 1.72 17
155 3.44 34
168 1.1 11
169 2.75 28
183 2.06 21
196 1.76 18
197 2.5 25
210 1.33 13
211 2.15 22
224 1.41 14
239 1.32 13
253 2.12 21
267 1.7 17
296 1.86 19
366 1.95 20
//