MassBank Record: JP001660



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

ACCESSION: JP001660
RECORD_TITLE: PARA-NITROBENZALDEHYDE; 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$NAME: PARA-NITROBENZALDEHYDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H5NO3 CH$EXACT_MASS: 151.02694 CH$SMILES: O=Cc(c1)ccc(c1)[N+1]([O-1])=O CH$IUPAC: InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H
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$SPLASH: splash10-0udi-9500000000-5c59f32e9a8085f6918f PK$NUM_PEAK: 39 PK$PEAK: m/z int. rel.int. 26 1.39 14 27 9.07 91 28 6.14 61 29 10.46 105 30 15.27 153 37 5.58 56 38 8.02 80 39 13.6 136 46 1.39 14 49 3.14 31 50 47 470 51 99.99 999 52 4.81 48 53 2.09 21 61 2.65 27 62 3.97 40 63 6.21 62 64 4.88 49 65 15.97 160 66 1.26 13 73 3.42 34 74 19.04 190 75 17.43 174 76 26.36 264 77 91.91 919 78 5.93 59 92 12.06 121 93 3.7 37 94 1.39 14 103 1.67 17 104 22.94 229 105 28.8 288 106 2.16 22 120 10.25 103 121 1.74 17 135 1.74 17 150 98.33 983 151 96.23 962 152 8.23 82 //