MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011972
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011972
RECORD_TITLE: BICYCLO(4.3.0)NONAN-7-OL (7-D); 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$NAME: BICYCLO(4.3.0)NONAN-7-OL (7-D)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H16O
CH$EXACT_MASS: 140.12012
CH$SMILES: [2H]C(O)(C1)C(C2)C(CCC2)C1
CH$IUPAC: InChI=1S/C9H16O/c10-9-6-5-7-3-1-2-4-8(7)9/h7-10H,1-6H2/i9D
CH$LINK: INCHIKEY
WHHUTBUNHHDROB-QOWOAITPSA-N
AC$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: splash10-00sj-9200000000-eaf4e9c8e83d7fcc2eee
PK$NUM_PEAK: 61
PK$PEAK: m/z int. rel.int.
28 2.1 21
29 2.9 29
30 1 10
31 1.2 12
41 9.6 96
42 6.9 69
43 10.3 103
44 1.5 15
45 3.8 38
46 1.7 17
52 1 10
53 1.5 15
54 14.1 141
55 25.1 251
56 18.6 186
57 14 140
58 9.6 96
59 27.1 271
60 2.6 26
66 6 60
67 48.1 481
68 26.3 263
69 9.2 92
70 2.8 28
71 4.2 42
72 2.2 22
73 1.7 17
77 1.2 12
78 2.1 21
79 9.7 97
80 22 220
81 99.99 999
82 25.4 254
83 21.3 213
84 7.6 76
85 2.6 26
86 2.9 29
91 1.2 12
92 1.4 14
93 9.3 93
94 34.5 345
95 27.2 272
96 54.9 549
97 32.2 322
98 5.6 56
99 2.9 29
100 1.4 14
107 4.8 48
108 6.8 68
109 4.7 47
110 1.5 15
111 1.7 17
112 6.9 69
113 4.9 49
121 1.1 11
122 6.3 63
123 99.8 998
124 13.9 139
125 1.7 17
141 5.3 53
142 1.1 11
//