MassBank Record: JP000440



 2,3-DIMETHYL-7-NITROINDOLE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000440
RECORD_TITLE: 2,3-DIMETHYL-7-NITROINDOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 2,3-DIMETHYL-7-NITROINDOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H10N2O2 CH$EXACT_MASS: 190.07423 CH$SMILES: [O-1][N+1](=O)c(c2)c(n1)c(cc2)c(C)c(C)1 CH$IUPAC: InChI=1S/C10H10N2O2/c1-6-7(2)11-10-8(6)4-3-5-9(10)12(13)14/h3-5,11H,1-2H3
AC$INSTRUMENT: MX-1303 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-8900000000-49f2a085293f933d63d6 PK$NUM_PEAK: 52 PK$PEAK: m/z int. rel.int. 45 26.8 268 50 3 30 51 6.3 63 52 0.37 4 53 5.2 52 54 3.1 31 55 18.4 184 56 0.92 9 57 36.6 366 60 16.7 167 63 4.4 44 65 0.47 5 67 7.5 75 68 6 60 69 41.1 411 70 0.74 7 71 14 140 73 16.4 164 74 3.4 34 75 0.34 3 77 11.3 113 79 4.5 45 81 13.4 134 82 0.37 4 83 11.3 113 84 3.8 38 85 6.3 63 89 0.38 4 91 10.1 101 93 3 30 95 6.3 63 97 0.71 7 98 3 30 101 3.5 35 102 5 50 103 0.35 4 115 21.1 211 116 7.7 77 117 7.4 74 128 0.66 7 129 14 140 132 3.9 39 142 6.3 63 143 4.2 42 144 62.5 625 145 6 60 149 4.7 47 160 0.33 3 175 15.8 158 189 32.1 321 190 99.99 999 191 12.3 123 //