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MassBank Record: WA001880

Ramipril; LC-ESI-Q; MS; POS; 45 V

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

ACCESSION: WA001880
RECORD_TITLE: Ramipril; LC-ESI-Q; MS; POS; 45 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 45 V

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

PK$SPLASH: splash10-001i-0391200000-0681c6b6371720838cfd
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  110 8 8
  117 24 24
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  156 94 94
  160 74 74
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  234 999 999
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  236 16 16
  242 16 16
  302 16 16
  343 157 157
  344 31 31
  417 262 262
  418 59 59
  419 8 8
//

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