MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006309
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006309
RECORD_TITLE: FILIFOLIDE A; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: FILIFOLIDE A
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H14O2
CH$EXACT_MASS: 166.09938
CH$SMILES: CC(=C1)C([H])(O2)CC([H])(C(=O)2)C(C)(C)1
CH$IUPAC: InChI=1S/C10H14O2/c1-6-5-10(2,3)7-4-8(6)12-9(7)11/h5,7-8H,4H2,1-3H3/t7-,8-/m0/s1
CH$LINK: INCHIKEY
JHKNAYGQYUKKDQ-YUMQZZPRSA-N
AC$INSTRUMENT: HITACHI RMS-4
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4l-9700000000-67a4efc9877d11e0a66a
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
40 5.2 52
41 33.1 331
42 4.7 47
43 0.67 7
44 1 10
45 1.5 15
50 5 50
51 0.95 10
52 4.3 43
53 11.2 112
54 2.3 23
55 0.93 9
62 1.3 13
63 3.8 38
64 1.2 12
65 1.05 11
66 2.7 27
67 7.7 77
68 1.3 13
69 0.43 4
70 2.7 27
77 12.2 122
78 4.7 47
79 0.15 2
80 2.7 27
81 2.8 28
82 1.8 18
83 0.2 2
91 40.5 405
92 6.5 65
93 4.7 47
94 0.18 2
95 3.5 35
96 1.2 12
98 3.2 32
105 1.5 15
106 2.7 27
107 99.99 999
108 11.2 112
109 0.23 2
111 2 20
121 2.8 28
122 20 200
123 0.53 5
138 1 10
151 1.2 12
166 5.2 52
167 1.8 18
//