MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006926
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006926
RECORD_TITLE: FENCHYL ALCOHOL; 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$NAME: FENCHYL ALCOHOL
CH$NAME: 1,3,3-TRIMETHYLBICYCLO(2.2.1)HEPTAN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: OC(C(C)(C)1)C(C)(C2)CC(C2)1
CH$IUPAC: InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3
CH$LINK: INCHIKEY
IAIHUHQCLTYTSF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1041970
AC$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 10 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-9000000000-6704d50bcfa35df1f886
PK$NUM_PEAK: 62
PK$PEAK: m/z int. rel.int.
15 1.18 12
18 1.48 15
27 14.76 148
28 2.67 27
29 12.18 122
31 2.53 25
39 19.7 197
40 3.39 34
41 39.07 391
42 3.93 39
43 34.66 347
44 1.53 15
45 3.46 35
51 3.45 35
52 1.29 13
53 12.45 125
54 3.31 33
55 20.01 200
56 4.7 47
57 15.98 160
59 1.37 14
65 3.79 38
66 1.51 15
67 22.04 220
68 4.02 40
69 24.69 247
70 4.06 41
71 24.32 243
72 23.16 232
73 2.52 25
77 6.1 61
78 1.09 11
79 9.57 96
80 63.02 630
81 99.99 999
82 18.72 187
83 13.33 133
84 20.31 203
85 4.83 48
91 4.16 42
92 3.28 33
93 14.74 147
94 2.13 21
95 7.14 71
96 4.26 43
97 4.95 50
98 3.54 35
99 1.35 14
105 1.23 12
107 11.64 116
108 1.65 17
109 2.12 21
110 1.48 15
111 14.23 142
112 1.37 14
121 11.81 118
122 1.08 11
123 4.6 46
125 1.8 18
136 2.9 29
139 4.95 50
154 2.04 20
//