MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009481
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009481
RECORD_TITLE: EPIBROMOHYDRIN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA
CH$NAME: EPIBROMOHYDRIN
CH$NAME: 1-BROMO-2,3-EPOXYPROPANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H5BrO
CH$EXACT_MASS: 135.95238
CH$SMILES: C(O1)C1CBr
CH$IUPAC: InChI=1S/C3H5BrO/c4-1-3-2-5-3/h3H,1-2H2
CH$LINK: CAS
3132-64-7
CH$LINK: INCHIKEY
GKIPXFAANLTWBM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5025237
AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-0a6r-9000000000-6ba4a0f2a0dd3b99910d
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
14 3.27 33
15 4.77 48
25 1.7 17
26 13.02 130
27 47.61 476
28 7.24 72
29 35.5 355
30 3.42 34
31 29.24 292
37 1.67 17
38 2.84 28
39 6.54 65
41 1.18 12
42 3.21 32
43 3.64 36
55 1.13 11
57 99.99 999
58 3.58 36
79 4.47 45
80 1.86 19
81 4.84 48
82 1.79 18
83 5.61 56
93 5.12 51
95 1.44 14
105 2.65 27
107 1.95 20
108 2.09 21
123 1.81 18
125 1.71 17
//