MassBank Record: JP002810



 2-METHYL-3-(2-METHYLPHENYL)-4(3H)-QUINAZOLINONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002810
RECORD_TITLE: 2-METHYL-3-(2-METHYLPHENYL)-4(3H)-QUINAZOLINONE; 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$NAME: 2-METHYL-3-(2-METHYLPHENYL)-4(3H)-QUINAZOLINONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H14N2O CH$EXACT_MASS: 250.11061 CH$SMILES: Cc(c3)c(ccc3)N(C(C)=1)C(=O)c(c2)c(ccc2)N1 CH$IUPAC: InChI=1S/C16H14N2O/c1-11-7-3-6-10-15(11)18-12(2)17-14-9-5-4-8-13(14)16(18)19/h3-10H,1-2H3
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0f79-8490000000-13cbb7614902871f6c7d PK$NUM_PEAK: 189 PK$PEAK: m/z int. rel.int. 37 1 10 38 2 20 39 16.2 162 40 1.8 18 41 6 60 42 2.2 22 43 1.8 18 44 0.75 8 45 1 10 46 0.1 1 47 1.2 12 48 0.01 0 49 1.5 15 50 10 100 51 10.6 106 52 0.31 3 53 2.2 22 54 1 10 55 2 20 56 0.24 2 57 2 20 58 3 30 59 1 10 60 0.04 0 61 1 10 62 2.1 21 63 7 70 64 0.04 0 65 22.4 224 66 2.6 26 67 1.8 18 68 0.01 0 69 1.9 19 70 1 10 71 1.2 12 72 0.02 0 73 2 20 74 2.8 28 75 6.2 62 76 1.75 18 77 15 150 78 5.2 52 79 3 30 80 0.01 0 81 1.4 14 82 1 10 83 0.2 2 84 0.15 2 85 1 10 86 1 10 87 1 10 88 0.01 0 89 9.1 91 90 8.4 84 91 37 370 92 0.42 4 93 1 10 94 1 10 95 0.5 5 96 0.04 0 97 0.1 1 100 0.2 2 101 1 10 102 0.05 1 103 3 30 104 4.1 41 105 2.1 21 106 0.01 0 107 1.7 17 108 0.8 8 109 1 10 110 0.01 0 111 0.2 2 112 0.1 1 114 1 10 115 0.02 0 116 6 60 117 7 70 118 1.5 15 119 0.15 2 120 2.9 29 121 1.5 15 122 0.4 4 123 0.01 0 124 1 10 125 2 20 126 1 10 127 0.11 1 128 1 10 129 1.2 12 130 2.5 25 131 0.18 2 132 17 170 133 2.2 22 134 0.5 5 135 0.02 0 136 0.4 4 137 1 10 138 0.5 5 139 0.01 0 140 1 10 141 0.9 9 142 0.4 4 143 0.77 8 144 2.4 24 145 1.1 11 146 1.4 14 147 0.08 1 149 2.8 28 150 1 10 151 1.6 16 152 0.29 3 153 1.8 18 154 1 10 155 1 10 156 0.09 1 157 0.4 4 158 0.1 1 162 0.4 4 163 0.01 0 164 1 10 165 2.6 26 166 1.5 15 167 0.1 1 168 0.5 5 176 0.4 4 177 1 10 178 0.18 2 179 1.8 18 180 4 40 181 1.5 15 182 0.04 0 183 0.2 2 189 0.5 5 190 2 20 191 0.09 1 192 1.2 12 193 1 10 194 1 10 195 0.18 2 196 1 10 197 1.7 17 198 0.5 5 203 0.05 1 204 1 10 205 2.9 29 206 3.5 35 207 0.05 1 208 3 30 209 1.5 15 210 0.5 5 211 0.15 2 212 0.5 5 213 0.2 2 214 0.4 4 215 0.05 1 216 0.5 5 217 6 60 218 3 30 219 0.16 2 220 1 10 221 2.9 29 222 1 10 223 0.01 0 224 0.5 5 230 0.5 5 231 1.4 14 232 0.25 3 233 29.2 292 234 9.5 95 235 99.99 999 236 0.2 2 237 3 30 238 1 10 239 0.4 4 240 0.05 1 246 0.4 4 247 1 10 248 0.9 9 249 0.81 8 250 40 400 251 8.1 81 252 2 20 253 0.24 2 254 1 10 255 1 10 256 1 10 257 0.05 1 148 0.4 4 //