MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006798
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006798
RECORD_TITLE: FLUOROBENZENE; 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$NAME: FLUOROBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H5F
CH$EXACT_MASS: 96.03753
CH$SMILES: Fc(c1)cccc1
CH$IUPAC: InChI=1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H
CH$LINK: INCHIKEY
PYLWMHQQBFSUBP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4025329
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$SPLASH: splash10-0002-9000000000-2aa4563aac2d6d44c333
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
31 1.42 14
37 2.16 22
38 2.7 27
39 5.53 55
48 1.62 16
49 1.35 14
50 12.34 123
51 6.07 61
52 1.01 10
57 3.64 36
63 3.3 33
68 2.29 23
69 3.3 33
70 21.71 217
74 3.37 34
75 6.81 68
76 2.16 22
77 1.28 13
94 1.35 14
95 5.6 56
96 99.99 999
97 6.07 61
//