MassBank Record: JP003099



 4-ETHOXYCARBONYL-1-METHYL-4-PHENYLPIPERIDINE MEPERIDINE,DEMEROL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003099
RECORD_TITLE: 4-ETHOXYCARBONYL-1-METHYL-4-PHENYLPIPERIDINE MEPERIDINE,DEMEROL; 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$NAME: 4-ETHOXYCARBONYL-1-METHYL-4-PHENYLPIPERIDINE MEPERIDINE,DEMEROL CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H21NO2 CH$EXACT_MASS: 247.15723 CH$SMILES: CCOC(=O)C(C2)(CCN(C)C2)c(c1)cccc1 CH$IUPAC: InChI=1S/C15H21NO2/c1-3-18-14(17)15(9-11-16(2)12-10-15)13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3
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: splash10-00dl-9310000000-9f5598127b487d9339dc PK$NUM_PEAK: 195 PK$PEAK: m/z int. rel.int. 25 22 220 26 13.2 132 27 22 220 28 4.69 47 29 8.2 82 30 4 40 31 1.9 19 32 0.14 1 33 0.1 1 34 0.2 2 35 0.1 1 36 0.09 1 37 1.2 12 38 1.6 16 39 6.8 68 40 0.22 2 41 6.4 64 42 49 490 43 31 310 45 0.21 2 46 0.2 2 47 0.1 1 48 0.1 1 49 0.02 0 50 3.4 34 51 8.2 82 52 3.6 36 53 0.46 5 54 1.9 19 55 2.9 29 56 5.1 51 57 3.31 33 58 12.8 128 59 1.2 12 60 0.4 4 61 0.08 1 62 1.4 14 63 3.9 39 64 1.7 17 65 0.45 5 66 1.2 12 67 1.6 16 68 1.7 17 69 0.13 1 70 54 540 71 99.99 999 72 7.1 71 73 0.08 1 74 1.4 14 75 2 20 76 2.9 29 77 0.12 1 78 6 60 79 3.8 38 80 1.5 15 81 0.18 2 82 2.6 26 83 1.8 18 84 1.4 14 85 0.08 1 86 1 10 87 2 20 88 0.6 6 89 0.27 3 90 1 10 91 18 180 92 2.2 22 93 0.08 1 94 2.6 26 95 1 10 96 11.9 119 97 0.02 0 98 1 10 99 1.4 14 100 1 10 101 0.12 1 102 4.7 47 103 16 160 104 4 40 105 0.27 3 106 1.2 12 107 1.4 14 108 1.2 12 109 0.08 1 110 0.4 4 111 0.2 2 112 0.4 4 113 0.06 1 114 0.8 8 115 12.9 129 116 5.8 58 117 0.05 1 118 2.1 21 119 1.2 12 120 1.4 14 121 0.46 5 122 1.4 14 123 0.2 2 124 0.1 1 125 0.01 0 126 1.5 15 127 4 40 128 7.4 74 129 0.81 8 130 4.2 42 131 8.1 81 132 2.4 24 133 0.01 0 134 1 10 135 0.4 4 136 0.4 4 137 0.02 0 138 0.1 1 139 0.4 4 140 7.4 74 141 0.24 2 142 1.8 18 143 2.3 23 144 3.6 36 145 0.12 1 146 1.4 14 147 0.8 8 148 0.4 4 149 0.12 1 150 0.1 1 151 0.1 1 152 0.4 4 153 0.05 1 154 3.2 32 155 7.1 71 156 3.3 33 157 0.27 3 158 4.7 47 159 1.9 19 160 0.8 8 161 0.05 1 162 1.1 11 163 0.4 4 164 0.1 1 165 0.02 0 166 0.4 4 167 1.4 14 168 1.4 14 169 0.42 4 170 2.4 24 171 1.1 11 172 29.5 295 173 0.69 7 174 14.2 142 175 4.1 41 176 1.1 11 177 0.15 2 178 0.4 4 179 0.2 2 180 0.2 2 181 0.02 0 182 0.2 2 183 0.4 4 184 0.6 6 185 0.07 1 186 0.6 6 187 0.4 4 188 0.3 3 189 0.04 0 190 3.4 34 191 1 10 192 0.2 2 193 0.01 0 198 0.2 2 199 0.1 1 200 0.7 7 201 0.04 0 202 2.1 21 203 0.4 4 204 0.5 5 205 0.02 0 213 0.8 8 214 1.1 11 215 1.2 12 216 0.02 0 217 0.1 1 218 13.4 134 219 3.1 31 220 0.01 0 232 6.8 68 233 1.6 16 234 0.2 2 235 0.01 0 245 0.6 6 246 14.7 147 247 22 220 248 0.42 4 249 0.7 7 250 0.2 2 251 0.1 1 //