MassBank Record: JP002777



 1,3-DIMETHYL-4-PHENYL-4-PIPERIDINOL PROPANOATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002777
RECORD_TITLE: 1,3-DIMETHYL-4-PHENYL-4-PIPERIDINOL PROPANOATE; 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$NAME: 1,3-DIMETHYL-4-PHENYL-4-PIPERIDINOL PROPANOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H23NO2 CH$EXACT_MASS: 261.17288 CH$SMILES: CCC(=O)OC(C2)(C(C)CN(C)C2)c(c1)cccc1 CH$IUPAC: InChI=1S/C16H23NO2/c1-4-15(18)19-16(14-8-6-5-7-9-14)10-11-17(3)12-13(16)2/h5-9,13H,4,10-12H2,1-3H3
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: splash10-0096-8900000000-0b6d048ecbb02d01d608 PK$NUM_PEAK: 149 PK$PEAK: m/z int. rel.int. 35 0.3 3 36 2.3 23 37 1.6 16 38 0.19 2 39 10 100 40 2.5 25 41 16.1 161 42 6.53 65 43 27.9 279 44 34 340 45 9.3 93 46 0.09 1 49 0.1 1 50 4 40 51 10.9 109 52 0.41 4 53 3.3 33 54 2.8 28 55 8 80 56 0.2 2 57 28.1 281 58 18 180 59 1.6 16 62 0.19 2 63 4.1 41 64 2 20 65 8.8 88 66 0.19 2 67 4.1 41 68 4.9 49 69 3.5 35 70 1.38 14 71 4.9 49 72 2.1 21 73 9.1 91 74 1.37 14 75 4 40 76 3.9 39 77 19.8 198 78 0.69 7 79 4.9 49 80 1.9 19 81 2.2 22 82 0.67 7 83 3.5 35 84 54.4 544 85 4.1 41 86 0.28 3 87 1.2 12 88 1.1 11 89 4.9 49 90 0.11 1 91 32.8 328 92 4.9 49 93 1.1 11 94 0.15 2 95 11.1 111 96 2.2 22 97 6.5 65 98 0.13 1 99 0.8 8 100 1.1 11 101 1.7 17 102 0.67 7 103 7 70 104 3.8 38 105 13.7 137 106 0.17 2 107 0.2 2 108 4 40 109 1.7 17 110 1.12 11 111 2.3 23 113 1.1 11 114 1.2 12 115 2.43 24 116 6 60 117 9.9 99 118 2.3 23 119 0.02 0 120 0.1 1 126 1.7 17 127 6 60 128 1.81 18 129 48.4 484 130 8.9 89 131 5.2 52 132 0.21 2 133 1.5 15 134 0.8 8 138 0.2 2 139 0.28 3 140 2.1 21 141 6 60 142 2.8 28 143 0.89 9 144 39.9 399 145 12.2 122 146 2.2 22 147 0.11 1 150 0.1 1 151 0.2 2 152 0.9 9 153 0.15 2 154 3.1 31 155 2.8 28 156 2.1 21 157 0.43 4 158 7.1 71 159 1.9 19 160 1.1 11 165 0.06 1 166 1.7 17 167 4.9 49 168 6.9 69 169 0.79 8 170 8.1 81 171 3.7 37 172 99.99 999 173 1.22 12 174 2.7 27 175 1.1 11 176 0.3 3 182 0.12 1 183 1.7 17 184 3.1 31 185 1.6 16 186 0.13 1 187 66.3 663 188 19.1 191 189 4.4 44 190 0.11 1 191 0.8 8 200 0.1 1 201 0.8 8 202 0.12 1 203 1.1 11 204 1.7 17 205 1.1 11 206 0.07 1 249 0.1 1 250 0.7 7 252 0.7 7 259 0.01 0 260 2.1 21 261 6.4 64 262 1.7 17 263 0.01 0 125 0.1 1 //