MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001672
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001672
RECORD_TITLE: ETHYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: ETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10
CH$EXACT_MASS: 106.07825
CH$SMILES: CCc(c1)cccc1
CH$IUPAC: InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
CH$LINK: INCHIKEY
YNQLUTRBYVCPMQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3020596
AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0006-9200000000-c2b5306fbaeb48134d6b
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
27 2.32 23
39 5.06 51
50 2.93 29
51 9.15 92
52 2.99 30
63 2.62 26
65 7.87 79
77 7.5 75
78 5.49 55
79 3.97 40
89 1.65 17
91 99.99 999
92 7.38 74
103 3.05 31
105 5.98 60
106 32.95 330
107 2.62 26
//