MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005126
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005126
RECORD_TITLE: (Z)-2-TRIDECEN-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, FAC. OF SCIENCE AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: (Z)-2-TRIDECEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H26O
CH$EXACT_MASS: 198.19837
CH$SMILES: CCCCCCCCCCC([H])=C([H])CO
CH$IUPAC: InChI=1S/C13H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h11-12,14H,2-10,13H2,1H3/b12-11-
CH$LINK: INCHIKEY
VPYJHNADOJDSGU-QXMHVHEDSA-N
AC$INSTRUMENT: JEOL JMS-HX-100
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: splash10-0aou-9000000000-d100174becd06d967c78
PK$NUM_PEAK: 57
PK$PEAK: m/z int. rel.int.
39 12.38 124
40 2.69 27
41 58.84 588
42 16.18 162
43 73.61 736
44 14.77 148
45 5.61 56
51 0.87 9
52 0.65 7
53 7.3 73
54 25.01 250
55 54.07 541
56 28.67 287
57 99.99 999
58 10.24 102
59 1.15 12
65 1.39 14
66 6.31 63
67 39.86 399
68 43.11 431
69 35.54 355
70 20.88 209
71 20.02 200
72 7.29 73
73 1.92 19
77 1.07 11
79 2.81 28
80 2.41 24
81 32.68 327
82 52.36 524
83 27.85 279
84 10.36 104
85 8.2 82
86 1.47 15
93 0.71 7
94 1.54 15
95 27.15 272
96 27.44 274
97 14.99 150
98 4.67 47
99 2.72 27
109 11.99 120
110 8.99 90
111 4.32 43
112 2.01 20
113 0.99 10
123 5.13 51
124 5.85 59
125 1.27 13
126 1.54 15
137 2.27 23
138 1.83 18
151 0.67 7
152 2.41 24
180 1.16 12
181 0.18 2
198 0.35 4
//
system version 2.2.6-SNAPSHOT