MassBank Record: JP000215



 ORTHO NITRO PHENOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000215
RECORD_TITLE: ORTHO NITRO PHENOL; 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$NAME: ORTHO NITRO PHENOL CH$NAME: ORTHO HYDROXY NITROBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H5NO3 CH$EXACT_MASS: 139.02694 CH$SMILES: [O-1][N+1](=O)c(c1)c(O)ccc1 CH$IUPAC: InChI=1S/C6H5NO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H
AC$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: splash10-000i-9400000000-9f71669040926044f8d0 PK$NUM_PEAK: 28 PK$PEAK: m/z int. rel.int. 26 2.06 21 27 5.79 58 28 3.89 39 30 5.4 54 37 3.17 32 38 10 100 39 40.63 406 50 4.05 41 51 8.41 84 52 3.73 37 53 14.44 144 61 1.75 18 62 5.16 52 63 27.3 273 64 25.32 253 65 45.48 455 66 4.21 42 78 3.17 32 81 16.75 168 92 8.1 81 93 11.35 114 94 4.52 45 106 2.86 29 109 14.29 143 122 6.35 64 123 2.22 22 139 99.99 999 140 6.67 67 //