ACCESSION: MSBNK-Waters-WA002216
RECORD_TITLE: Mepyramine; 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$NAME: Mepyramine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₂₃N₃O
CH$EXACT_MASS: 285.18411
CH$SMILES: CN(C)CCN(Cc(c2)ccc(OC)c2)c(c1)nccc1
CH$IUPAC: InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3
CH$LINK: CAS 91-84-9
CH$LINK: INCHIKEY YECBIJXISLIIDS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9023542

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 12.980 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$SPLASH: splash10-00di-0930000000-2e1b95a0590423d6e4d2
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  119 16 16
  121 999 999
  122 86 86
  241 321 321
  242 43 43
  286 16 16
//