MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001589
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001589
RECORD_TITLE: ACENAPHTHENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
CH$NAME: ACENAPHTHENE
CH$NAME: 1,2-DIHYDROACENAPHTHYLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10
CH$EXACT_MASS: 154.07825
CH$SMILES: c(c3)cc(C1)c(c32)c(ccc2)C1
CH$IUPAC: InChI=1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2
CH$LINK: CAS
83-32-9
CH$LINK: COMPTOX
DTXSID3021774
CH$LINK: INCHIKEY
CWRYPZZKDGJXCA-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:6734
AC$INSTRUMENT: VARIAN MAT-44
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: splash10-0udi-4900000000-c935620a466205270abe
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
50 8.27 83
51 10.58 106
52 1.69 17
61 2.16 22
62 7.18 72
63 17.33 173
64 7.18 72
73 1.47 15
74 8.18 82
75 19.76 198
76 46.22 462
77 16.49 165
78 1.31 13
86 2.62 26
87 3.41 34
89 1.28 13
98 2.8 28
99 2 20
100 1.15 12
101 1.94 19
102 2.11 21
115 1.15 12
125 2.08 21
126 5.19 52
127 3.26 33
128 1.36 14
149 2.72 27
150 11.43 114
151 27.26 273
152 65.67 657
153 92.28 923
154 99.99 999
155 10.33 103
//