MassBank Record: PR010138



 Amantadine; GC-EI-TOF; MS; 1 TMS; BP:166 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PR010138
RECORD_TITLE: Amantadine; GC-EI-TOF; MS; 1 TMS; BP:166
DATE: 2016.01.19 (Created 2006.12.21, modified 2011.05.06)
AUTHORS: Kusano M, Fukushima A, Plant Science Center, RIKEN.
LICENSE: CC BY-SA

CH$NAME: Amantadine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C10H17N CH$EXACT_MASS: 151.13610 CH$SMILES: NC(C3)(C1)CC(C2)CC(CC23)1 CH$IUPAC: InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2 CH$LINK: CAS 211-560-2
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies AC$INSTRUMENT_TYPE: GC-EI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$CHROMATOGRAPHY: RETENTION_INDEX 1492 AC$CHROMATOGRAPHY: RETENTION_TIME 363.037 sec
MS$FOCUSED_ION: BASE_PEAK 166 MS$FOCUSED_ION: DERIVATIVE_FORM C13H25NSi MS$FOCUSED_ION: DERIVATIVE_MASS 223.17563 MS$FOCUSED_ION: DERIVATIVE_TYPE 1 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-01b9-6910000000-e6fd5b29f51169a772e5 PK$NUM_PEAK: 126 PK$PEAK: m/z int. rel.int. 60 26 26 61 5 5 62 3 3 63 5 5 64 2 2 65 39 39 66 21 21 67 75 75 68 3 3 69 10 10 70 19 19 71 13 13 72 28 28 73 648 648 74 104 104 75 21 21 76 7 7 77 95 95 78 18 18 79 101 101 80 25 25 81 33 33 82 13 13 83 16 16 84 18 18 85 16 16 86 10 10 87 2 2 88 5 5 89 2 2 90 3 3 91 78 78 92 14 14 93 81 81 94 95 95 95 22 22 96 10 10 97 10 10 98 25 25 99 9 9 100 19 19 101 3 3 102 5 5 103 3 3 104 7 7 105 12 12 106 8 8 107 20 20 108 18 18 109 9 9 110 14 14 111 5 5 112 9 9 113 11 11 114 81 81 115 18 18 116 5 5 117 3 3 118 1 1 119 3 3 120 7 7 121 3 3 122 3 3 123 4 4 124 9 9 125 4 4 126 11 11 127 2 2 128 7 7 129 198 198 130 30 30 131 10 10 132 4 4 133 4 4 134 11 11 135 29 29 136 15 15 137 3 3 138 6 6 139 5 5 140 7 7 141 2 2 142 3 3 143 1 1 146 2 2 147 1 1 148 10 10 149 5 5 150 252 252 151 49 49 152 27 27 153 9 9 154 10 10 155 3 3 156 1 1 157 1 1 158 1 1 159 1 1 160 1 1 161 1 1 162 2 2 163 1 1 164 12 12 165 6 6 166 999 999 167 189 189 168 52 52 169 6 6 178 1 1 179 2 2 180 47 47 181 12 12 182 6 6 183 1 1 192 1 1 194 1 1 206 2 2 207 1 1 208 146 146 209 28 28 210 7 7 222 7 7 223 177 177 224 35 35 225 9 9 226 1 1 //