ACCESSION: MSBNK-Waters-WA000506
RECORD_TITLE: Fenspiride; LC-ESI-Q; MS; POS; 75 V, 90 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Fenspiride
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₀N₂O₂
CH$EXACT_MASS: 260.15248
CH$SMILES: O=C(N3)OC(C3)(C1)CCN(CCc(c2)cccc2)C1
CH$IUPAC: InChI=1S/C15H20N2O2/c18-14-16-12-15(19-14)7-10-17(11-8-15)9-6-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,16,18)
CH$LINK: CAS 5053-06-5
CH$LINK: INCHIKEY FVNFBBAOMBJTST-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4023048

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 10.380 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 75 V, 90 V

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

PK$SPLASH: splash10-0a4i-0900000000-02f4a268a9f6d45e2671
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  103 114 114
  105 999 999
  106 82 82
  118 16 16
  169 24 24
//