MassBank Record: JP000795



 2-AMINO-3-METHYLIMIDAZO(4,5-F)QUINOLINE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000795
RECORD_TITLE: 2-AMINO-3-METHYLIMIDAZO(4,5-F)QUINOLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-AMINO-3-METHYLIMIDAZO(4,5-F)QUINOLINE CH$NAME: IQ CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H10N4 CH$EXACT_MASS: 198.09055 CH$SMILES: Nc(n1)n(C)c(c2)c1c(c3)c(ncc3)c2 CH$IUPAC: InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)
AC$INSTRUMENT: VARIAN MAT-44S AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0002-5900000000-bd580419edf086e639c1 PK$NUM_PEAK: 106 PK$PEAK: m/z int. rel.int. 40 3.96 40 41 9.93 99 42 4.97 50 43 13.51 135 44 2.96 30 45 3.04 30 50 5.43 54 51 6.89 69 52 4.16 42 53 2.39 24 54 2 20 55 9.78 98 56 3.27 33 57 8.85 89 58 1.66 17 59 1.23 12 60 2 20 61 1.89 19 62 3.5 35 63 5.04 50 64 4.23 42 65 2.58 26 66 1.96 20 67 3.85 39 68 2.19 22 69 6.04 60 70 3.89 39 71 0.47 5 72 4.39 44 73 3.16 32 74 3 30 75 5.77 58 76 6.47 65 77 6.2 62 78 4.35 44 79 3.66 37 80 1.04 10 81 3.43 34 82 2.54 25 83 3.73 37 84 2.5 25 85 6.08 61 86 3.12 31 87 4.31 43 88 3.93 39 89 2.81 28 90 1.62 16 91 3.08 31 92 1.08 11 93 1.39 14 95 2.5 25 96 1.69 17 97 2.58 26 98 2.85 29 99 12.59 126 100 3.93 39 101 6.31 63 102 6.85 69 103 5.5 55 104 2.93 29 105 1.92 19 107 1.04 10 109 1.35 14 110 1.04 10 111 1.46 15 112 1.08 11 113 1.58 16 114 6.04 60 115 3.39 34 116 4.54 45 117 1.77 18 119 1.19 12 123 1.04 10 126 1.12 11 127 2.31 23 128 5.39 54 129 14.59 146 130 2.62 26 131 1.58 16 140 0.01 0 141 3.7 37 142 4.12 41 143 3.85 39 144 1.54 15 149 1.96 20 153 2.77 28 154 3 30 155 5.89 59 156 21.98 220 157 3.7 37 168 1.19 12 169 2.89 29 170 19.52 195 171 3.23 32 179 1.15 12 180 0.62 6 181 2.96 30 182 5.23 52 183 26.71 267 184 4.43 44 194 1.08 11 196 2.5 25 197 40.49 405 198 99.99 999 199 13.36 134 200 1.04 10 //