MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011975
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011975
RECORD_TITLE: BICYCLO(4.3.0)NONAN-8-ONE; 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$NAME: BICYCLO(4.3.0)NONAN-8-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H14O
CH$EXACT_MASS: 138.10447
CH$SMILES: O=C(C1)CC(C2)C(CCC2)1
CH$IUPAC: InChI=1S/C9H14O/c10-9-5-7-3-1-2-4-8(7)6-9/h7-8H,1-6H2
CH$LINK: INCHIKEY
HAMUKWWZXAKCAU-UHFFFAOYSA-N
AC$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: splash10-00lg-9300000000-ca8aefbb8818edece39c
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
28 2.3 23
32 1 10
39 1.3 13
40 1.8 18
41 9 90
42 2.1 21
43 2.4 24
45 1 10
53 2.8 28
54 23.9 239
55 10.3 103
56 5.9 59
57 9.7 97
58 1.5 15
64 2 20
65 1 10
66 3.1 31
67 32 320
68 24.7 247
69 7.2 72
70 6.3 63
71 2.2 22
77 1.3 13
78 1.3 13
79 8.8 88
80 8.6 86
81 47.7 477
82 26 260
83 4.9 49
84 4.1 41
85 1 10
91 5.3 53
92 4 40
93 4.9 49
94 99.99 999
95 29.1 291
96 27.7 277
97 3.1 31
98 1.3 13
103 1.2 12
105 25 250
106 3.8 38
107 2.2 22
109 9.9 99
110 4.9 49
111 1.2 12
116 1.9 19
120 4.4 44
121 1.9 19
122 8.8 88
123 3.5 35
133 1.1 11
134 13.3 133
135 1.6 16
137 2.3 23
138 53.3 533
139 6.2 62
140 1.6 16
//