MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007654
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007654
RECORD_TITLE: FENCHYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: FENCHYL ALCOHOL
CH$NAME: 1,3,3-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-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: CAS
1632-73-1
CH$LINK: INCHIKEY
IAIHUHQCLTYTSF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1041970
AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 15 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-9200000000-de1f34c5e46838e35a67
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
43 5.4 54
55 1.7 17
56 1.74 17
57 1.83 18
67 2.77 28
68 1.28 13
69 8.94 89
70 2.55 26
71 11.02 110
72 20.72 207
73 2.26 23
80 99.99 999
81 80.85 809
82 18.98 190
83 10.55 106
84 15.74 157
85 3.4 34
86 1.15 12
92 3.66 37
93 9.53 95
94 1.79 18
95 2.81 28
96 6.81 68
97 3.15 32
98 4.26 43
99 1.66 17
107 9.02 90
108 2.04 20
109 1.53 15
110 1.91 19
111 15.62 156
112 2.64 26
121 8.89 89
122 1.19 12
123 6.13 61
125 3.62 36
136 6.81 68
137 1.23 12
139 6.04 60
154 7.49 75
155 1.23 12
//