ACCESSION: MSBNK-Waters-WA002544
RECORD_TITLE: Pilocarpine; LC-ESI-Q; MS; POS; 60 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Pilocarpine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₆N₂O₂
CH$EXACT_MASS: 208.12118
CH$SMILES: CCC(C(=O)2)C(CO2)Cc(c1)n(C)cn1
CH$IUPAC: InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10-/m0/s1
CH$LINK: CAS 92-13-7
CH$LINK: INCHIKEY QCHFTSOMWOSFHM-WPRPVWTQSA-N
CH$LINK: COMPTOX DTXSID1021162

AC$INSTRUMENT: ZQ, Waters
AC$INSTRUMENT_TYPE: LC-ESI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$CHROMATOGRAPHY: RETENTION_TIME 16.180 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 60 V

MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-0ab9-0920000000-f0ac7e69bd79660ef665
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  105 59 59
  107 141 141
  108 20 20
  109 341 341
  110 27 27
  112 24 24
  113 16 16
  121 615 615
  122 407 407
  123 110 110
  132 24 24
  133 121 121
  134 121 121
  135 188 188
  136 98 98
  137 16 16
  138 12 12
  139 27 27
  146 12 12
  147 82 82
  148 82 82
  149 47 47
  151 78 78
  152 12 12
  161 35 35
  162 16 16
  163 556 556
  164 51 51
  165 16 16
  181 31 31
  182 16 16
  191 35 35
  209 999 999
  210 106 106
//