MassBank Record: JP001651



 1-ETHOXY-4-NITROBENZENE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001651
RECORD_TITLE: 1-ETHOXY-4-NITROBENZENE; 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$NAME: 1-ETHOXY-4-NITROBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H9NO3 CH$EXACT_MASS: 167.05824 CH$SMILES: CCOc(c1)ccc(c1)[N+1]([O-1])=O CH$IUPAC: InChI=1S/C8H9NO3/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6H,2H2,1H3
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$SPLASH: splash10-014r-9700000000-b86ce4714da069ea1c87 PK$NUM_PEAK: 33 PK$PEAK: m/z int. rel.int. 26 2.17 22 27 16.47 165 28 4.34 43 29 43.93 439 30 6.29 63 38 5.78 58 39 23.7 237 50 11.49 115 51 4.34 43 52 2.17 22 53 6.5 65 62 3.61 36 63 14.45 145 64 10.98 110 65 53.11 531 66 3.47 35 74 3.4 34 75 7.23 72 76 7.95 80 77 4.34 43 81 14.67 147 91 2.89 29 92 5.35 54 93 31.29 313 94 2.38 24 109 33.02 330 110 2.1 21 122 1.66 17 123 6.79 68 139 99.99 999 140 6.94 69 167 94.94 949 168 9.68 97 //