MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010371
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010371
RECORD_TITLE: ANTHRACENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ANTHRACENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H10
CH$EXACT_MASS: 178.07825
CH$SMILES: c(c3)cc(c1)c(c3)cc(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H
CH$LINK: CAS
120-12-7
CH$LINK: INCHIKEY
MWPLVEDNUUSJAV-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0023878
AC$INSTRUMENT: JEOL JMS-DX-300
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: splash10-004i-3900000000-e7b66d113908d54685ff
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
51 1.3 13
62 1.17 12
63 4.18 42
74 0.16 2
75 5.34 53
76 16.23 162
77 1.26 13
87 0.23 2
88 11.25 113
89 19.59 196
126 1.36 14
150 4.69 47
151 7.15 72
152 6.47 65
174 1.83 18
175 2.69 27
176 17.99 180
177 10.35 104
178 99.99 999
179 17.21 172
180 1.35 14
//