MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011970
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011970
RECORD_TITLE: BICYCLO(4.3.1)NONAN-7-OL; 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$NAME: BICYCLO(4.3.1)NONAN-7-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H16O
CH$EXACT_MASS: 140.12012
CH$SMILES: OC(C1)C(C2)C(CCC2)C1
CH$IUPAC: InChI=1S/C9H16O/c10-9-6-5-7-3-1-2-4-8(7)9/h7-10H,1-6H2
CH$LINK: INCHIKEY
WHHUTBUNHHDROB-UHFFFAOYSA-N
AC$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 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00si-9200000000-3fee1515f8a334457540
PK$NUM_PEAK: 68
PK$PEAK: m/z int. rel.int.
28 3.3 33
29 1.4 14
32 1.9 19
38 1.3 13
41 5.4 54
42 1.9 19
43 2.7 27
44 4.7 47
45 2.5 25
52 2.1 21
53 2.3 23
54 17.8 178
55 28.1 281
56 3 30
57 10.6 106
58 30.1 301
59 3.6 36
65 1.9 19
66 8.3 83
67 55.3 553
68 28.4 284
69 6 60
70 4.1 41
71 3 30
72 2.1 21
73 1.8 18
74 1.3 13
77 1.4 14
78 2.1 21
79 14.6 146
80 55.8 558
81 80.4 804
82 17.5 175
83 24.6 246
84 3.8 38
85 1 10
91 2.7 27
92 1.8 18
93 24.6 246
94 39.5 395
95 9.1 91
96 76.6 766
97 19 190
98 3.3 33
99 2.2 22
100 1.2 12
101 1.6 16
104 1.6 16
105 1.6 16
107 9.9 99
108 2.5 25
109 6.1 61
110 2 20
111 6.5 65
112 5.9 59
113 1.4 14
117 1.3 13
121 4.1 41
122 99.99 999
123 14.1 141
124 2.1 21
125 1.3 13
129 1.1 11
130 1.3 13
138 2.3 23
139 1.7 17
140 4.4 44
141 1.2 12
//