MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008785
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008785
RECORD_TITLE: ANTHRACENE (1,2,3,4,5,6,7,8,9,10-D10); EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA
CH$NAME: ANTHRACENE (1,2,3,4,5,6,7,8,9,10-D10)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H10
CH$EXACT_MASS: 178.07825
CH$SMILES: [2H]c(c([2H])3)c([2H])c(c([2H])1)c(c([2H])3)c([2H])c(c([2H])2)c(c([2H])c([2H])c([2H])2)1
CH$IUPAC: InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D
CH$LINK: COMPTOX
DTXSID9052684
CH$LINK: INCHIKEY
MWPLVEDNUUSJAV-LHNTUAQVSA-N
CH$LINK: PUBCHEM
CID:80291
AC$INSTRUMENT: HP 5970
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: splash10-000i-3900000000-ed716f06921a89f3fbc0
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
40 1.08 11
42 2.36 24
52 2.71 27
54 2.28 23
64 2.23 22
66 7.14 71
76 2.78 28
78 5.26 53
80 15.41 154
82 1.14 11
88 1.36 14
90 2.1 21
92 6.91 69
94 14.56 146
100 1.51 15
132 1.6 16
146 1.21 12
156 4.31 43
157 1.44 14
158 7.4 74
159 2.18 22
160 8.78 88
180 1.02 10
182 1.51 15
183 2.17 22
184 13.75 138
185 2.81 28
186 6.49 65
187 16.45 165
188 99.99 999
189 15.04 150
190 0.94 9
//