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MassBank Record: WA001879

Ramipril; LC-ESI-Q; MS; POS; 60 V

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

ACCESSION: WA001879
RECORD_TITLE: Ramipril; 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$NAME: Ramipril
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C23H32N2O5
CH$EXACT_MASS: 416.23112
CH$SMILES: CCOC(=O)C(CCc(c3)cccc3)NC(C)C(=O)N(C(C(O)=O)1)C([H])(C2)C([H])(CC2)C1
CH$IUPAC: InChI=1S/C23H32N2O5/c1-3-30-23(29)18(13-12-16-8-5-4-6-9-16)24-15(2)21(26)25-19-11-7-10-17(19)14-20(25)22(27)28/h4-6,8-9,15,17-20,24H,3,7,10-14H2,1-2H3,(H,27,28)/t15-,17-,18-,19-,20-/m0/s1
CH$LINK: CAS 87333-19-5
CH$LINK: INCHIKEY HDACQVRGBOVJII-JBDAPHQKSA-N
CH$LINK: COMPTOX DTXSID8023551

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 14.510 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$SPLASH: splash10-001i-0930000000-92b73750d439644be2e2
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  100 8 8
  102 114 114
  110 98 98
  117 552 552
  118 31 31
  130 717 717
  131 27 27
  132 8 8
  134 360 360
  135 20 20
  142 12 12
  143 8 8
  144 8 8
  156 168 168
  157 8 8
  160 490 490
  161 55 55
  162 16 16
  171 8 8
  175 8 8
  178 8 8
  206 27 27
  234 999 999
  235 137 137
  236 8 8
  256 16 16
  302 47 47
  343 67 67
  344 12 12
  417 31 31
//

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