MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006869
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006869
RECORD_TITLE: HEXADECANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: HEXADECANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H34O
CH$EXACT_MASS: 242.26097
CH$SMILES: CCCCCCCCCCCCCCCCO
CH$IUPAC: InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3
CH$LINK: INCHIKEY
BXWNKGSJHAJOGX-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4027991
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$SPLASH: splash10-0a4l-9000000000-1be6f87af09f0bc4339f
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
27 16.93 169
29 31.17 312
31 25.97 260
39 10.94 109
41 81.58 816
42 20.85 209
43 97.22 972
44 6.54 65
45 1.12 11
53 3.79 38
54 10.8 108
55 99.99 999
56 48.33 483
57 73.27 733
58 3.87 39
67 14.44 144
68 31.57 316
69 72.53 725
70 43.51 435
71 30.2 302
73 1.48 15
81 7.62 76
82 32.72 327
83 76.38 764
84 29.21 292
85 15.64 156
95 1.71 17
96 11.73 117
97 50.94 509
98 18.86 189
99 1.58 16
110 4.12 41
111 24.98 250
112 11.01 110
125 11.28 113
126 6.14 61
139 1.73 17
140 2.56 26
154 1.92 19
//