MassBank MassBank Search Contents Download

MassBank Record: WA000496

Medifoxamine; LC-ESI-Q; MS; POS; 90 V

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: WA000496
RECORD_TITLE: Medifoxamine; LC-ESI-Q; MS; POS; 90 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Medifoxamine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H19NO2
CH$EXACT_MASS: 257.14158
CH$SMILES: CN(C)CC(Oc(c2)cccc2)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C16H19NO2/c1-17(2)13-16(18-14-9-5-3-6-10-14)19-15-11-7-4-8-12-15/h3-12,16H,13H2,1-2H3
CH$LINK: CAS 32359-34-5
CH$LINK: INCHIKEY QNMGHBMGNRQPNL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID80186078

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 13.460 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 90 V

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

PK$SPLASH: splash10-0aor-0900000000-f5c71f99d96e9b6e6d58
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  102 31 31
  103 219 219
  104 27 27
  105 180 180
  106 94 94
  107 999 999
  108 172 172
  115 20 20
  116 490 490
  117 102 102
  118 713 713
  119 121 121
  120 168 168
  121 43 43
  128 12 12
  130 227 227
  131 82 82
  132 145 145
  133 121 121
  134 90 90
  144 102 102
  145 12 12
  146 67 67
  147 24 24
  148 184 184
  149 51 51
  152 20 20
  157 31 31
  160 24 24
  164 153 153
  165 12 12
  258 137 137
  259 12 12
//

Imprint Feedback
system version 2.1.8
Copyright © 2006 MassBank Project; 2011 NORMAN Association; 2021 MassBank Consortium
Responsible: Dr. Tobias Schulze