ACCESSION: MSBNK-RIKEN-PR010230
RECORD_TITLE: R-(-)-1-Amino-2-propanol; GC-EI-TOF; MS; 3 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$NAME: R-(-)-1-Amino-2-propanol
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C₃H₉NO
CH$EXACT_MASS: 75.06841
CH$SMILES: NCC(C)O
CH$IUPAC: InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3/t3-/m1/s1
CH$LINK: CAS 2799-16-8
CH$LINK: NIKKAJI J9.255J
CH$LINK: INCHIKEY HXKKHQJGJAFBHI-GSVOUGTGSA-N

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$CHROMATOGRAPHY: RETENTION_INDEX 1312.8
AC$CHROMATOGRAPHY: RETENTION_TIME 351.012 sec

MS$FOCUSED_ION: BASE_PEAK 73
MS$FOCUSED_ION: DERIVATIVE_FORM C12H33NOSi3
MS$FOCUSED_ION: DERIVATIVE_MASS 291.18699
MS$FOCUSED_ION: DERIVATIVE_TYPE 3 TMS
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)

PK$SPLASH: splash10-00di-8900000000-e6b034fd46546c0fb804
PK$NUM_PEAK: 79
PK$PEAK: m/z int. rel.int.
  60 22 22
  61 18 18
  62 1 1
  66 8 8
  67 1 1
  69 1 1
  70 14 14
  71 11 11
  72 27 27
  73 999 999
  74 91 91
  75 55 55
  76 4 4
  77 4 4
  82 1 1
  83 2 2
  84 7 7
  85 10 10
  86 273 273
  87 46 46
  88 13 13
  89 3 3
  98 3 3
  99 5 5
  100 140 140
  101 33 33
  102 42 42
  103 14 14
  104 3 3
  105 4 4
  112 4 4
  113 8 8
  114 117 117
  115 26 26
  116 22 22
  117 58 58
  118 9 9
  119 15 15
  120 2 2
  121 1 1
  128 21 21
  129 6 6
  130 48 48
  131 39 39
  132 11 11
  133 122 122
  134 18 18
  135 9 9
  136 1 1
  142 1 1
  143 1 1
  144 10 10
  145 3 3
  146 4 4
  147 119 119
  148 19 19
  149 9 9
  150 1 1
  158 7 7
  159 3 3
  160 2 2
  172 7 7
  173 2 2
  174 561 561
  175 112 112
  176 57 57
  177 7 7
  178 1 1
  186 3 3
  187 1 1
  188 13 13
  189 3 3
  190 1 1
  202 6 6
  203 1 1
  204 2 2
  276 13 13
  277 3 3
  278 1 1
//