MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009411
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009411
RECORD_TITLE: 9,10-DIHYDROPHENANTHRENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: 9,10-DIHYDROPHENANTHRENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H12
CH$EXACT_MASS: 180.09390
CH$SMILES: c(c3)cc(C1)c(c3)c(c2)c(ccc2)C1
CH$IUPAC: InChI=1S/C14H12/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-8H,9-10H2
CH$LINK: INCHIKEY
XXPBFNVKTVJZKF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID20228264
AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-0059-4900000000-a925caa9979d27ad3d93
PK$NUM_PEAK: 59
PK$PEAK: m/z int. rel.int.
26 1.25 13
27 9.56 96
29 16.1 161
30 1.74 17
31 13.43 134
38 2.61 26
39 13.66 137
41 1.41 14
44 1.32 13
50 6.03 60
51 9.78 98
52 2.68 27
56 1.1 11
62 3.2 32
63 14.8 148
64 2.64 26
65 2.14 21
69 1.03 10
74 4.89 49
75 7.06 71
76 13.92 139
77 5.05 51
78 1.09 11
82 1.01 10
83 3.2 32
86 2.48 25
87 3.77 38
88 5.99 60
89 14.34 143
90 5.65 57
91 2.32 23
98 1.77 18
99 2.31 23
101 1.08 11
102 1.98 20
113 1.22 12
115 3.65 37
126 2.24 22
127 1.57 16
128 2.84 28
139 4.06 41
141 1.03 10
150 3.69 37
151 9.24 92
152 13.02 130
153 3.91 39
154 2.39 24
163 1.47 15
164 1.89 19
165 29.46 295
166 6.26 63
175 1.8 18
176 10.15 102
177 8.43 84
178 40.84 408
179 57.41 574
180 99.99 999
181 11.85 119
182 1.38 14
//