MassBank Record: JP001988



 5-METHOXY-2,3-DIMETHYL-6-NITROINDOLE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001988
RECORD_TITLE: 5-METHOXY-2,3-DIMETHYL-6-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$NAME: 5-METHOXY-2,3-DIMETHYL-6-NITROINDOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H12N2O3 CH$EXACT_MASS: 220.08479 CH$SMILES: COc(c1)c([N+1]([O-1])=O)cc(n2)c1c(C)c(C)2 CH$IUPAC: InChI=1S/C11H12N2O3/c1-6-7(2)12-9-5-10(13(14)15)11(16-3)4-8(6)9/h4-5,12H,1-3H3
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$SPLASH: splash10-00di-2970000000-7bd62c29852c466d899f PK$NUM_PEAK: 47 PK$PEAK: m/z int. rel.int. 39 2 20 41 1.6 16 42 5 50 43 0.21 2 45 1.9 19 51 2.5 25 52 0.14 1 55 1.4 14 57 1.3 13 63 2.2 22 65 0.12 1 69 1.2 12 76 1.3 13 77 8.4 84 78 0.12 1 89 2.1 21 91 1.6 16 102 2.2 22 103 0.33 3 104 1.7 17 115 5 50 116 1.9 19 117 0.23 2 118 1.9 19 128 2.8 28 129 3.1 31 130 0.71 7 131 12.5 125 132 4.7 47 141 4.2 42 143 1.92 19 144 50 500 145 5.6 56 146 3.8 38 147 1.75 18 158 1.4 14 159 1 10 160 4.7 47 162 0.11 1 172 5.1 51 173 18 180 174 1.2 12 190 0.27 3 205 2.5 25 219 2.9 29 220 99.99 999 221 9.5 95 //