MassBank Record: PR010081



 1-Amino-1-cyclopentanecarboxylic acid; GC-EI-TOF; MS; 2 TMS; BP:73 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PR010081
RECORD_TITLE: 1-Amino-1-cyclopentanecarboxylic acid; GC-EI-TOF; MS; 2 TMS; BP:73
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$NAME: 1-Amino-1-cyclopentanecarboxylic acid CH$NAME: 1-Aminocyclopentanecarboxylate CH$NAME: 1-Aminocyclopentanecarboxylic acid CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C6H11NO2 CH$EXACT_MASS: 129.07898 CH$SMILES: OC(=O)C(N)(C1)CCC1 CH$IUPAC: InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9) CH$LINK: CAS 52-52-8 CH$LINK: KEGG C03969 CH$LINK: NIKKAJI J4.131I CH$LINK: PUBCHEM 6689
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$CHROMATOGRAPHY: RETENTION_INDEX 1365.8 AC$CHROMATOGRAPHY: RETENTION_TIME 333.172 sec
MS$FOCUSED_ION: BASE_PEAK 73 MS$FOCUSED_ION: DERIVATIVE_FORM C12H27NO2Si2 MS$FOCUSED_ION: DERIVATIVE_MASS 273.15803 MS$FOCUSED_ION: DERIVATIVE_TYPE 2 TMS MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-0ab9-8900000000-281b59b0ef8c6d49ce2d PK$NUM_PEAK: 112 PK$PEAK: m/z int. rel.int. 60 20 20 61 19 19 62 2 2 63 1 1 65 8 8 66 19 19 67 32 32 68 1 1 69 2 2 70 12 12 71 10 10 72 26 26 73 999 999 74 113 113 75 95 95 76 10 10 77 13 13 78 1 1 79 3 3 80 7 7 81 4 4 82 29 29 83 10 10 84 75 75 85 15 15 86 11 11 87 6 6 88 2 2 89 2 2 90 2 2 91 1 1 92 1 1 93 2 2 94 8 8 95 9 9 96 5 5 97 5 5 98 16 16 99 8 8 100 20 20 101 7 7 102 3 3 103 8 8 104 1 1 105 2 2 106 1 1 107 1 1 108 2 2 109 1 1 110 6 6 111 3 3 112 11 11 113 5 5 114 10 10 115 6 6 116 3 3 117 9 9 118 2 2 119 3 3 123 1 1 124 5 5 125 3 3 126 22 22 127 5 5 128 6 6 129 3 3 130 3 3 131 14 14 132 8 8 133 28 28 134 5 5 135 2 2 138 4 4 139 1 1 140 32 32 141 8 8 142 3 3 143 2 2 144 1 1 146 6 6 147 94 94 148 16 16 149 10 10 150 2 2 152 1 1 154 17 17 155 7 7 156 972 972 157 147 147 158 46 46 159 10 10 160 1 1 168 45 45 169 11 11 170 3 3 172 1 1 174 2 2 175 1 1 182 1 1 184 1 1 186 1 1 200 1 1 202 1 1 214 5 5 215 1 1 216 1 1 230 56 56 231 16 16 232 7 7 233 1 1 258 6 6 259 1 1 //