MassBank Record: JP009481

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EPIBROMOHYDRIN; EI-B; MS
Mass Spectrum
Chemical Structure
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metabolomics-usi visualisation

ACCESSION: JP009481
RECORD_TITLE: EPIBROMOHYDRIN; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 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 //