ACCESSION: MSBNK-Waters-WA002265
RECORD_TITLE: EDDP; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2012.05.21)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: EDDP
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₀H₂₃N
CH$EXACT_MASS: 277.18305
CH$SMILES: CC=C(N(C)3)C(CC(C)3)(c(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C20H23N/c1-4-19-20(15-16(2)21(19)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h4-14,16H,15H2,1-3H3/b19-4-
CH$LINK: CAS 66729-78-0
CH$LINK: INCHIKEY AJRJPORIQGYFMT-PVOVUMCXSA-N

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 13.800 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$SPLASH: splash10-004i-0190000000-b4ac46133cf3ede46a98
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  101 16 16
  103 67 67
  105 16 16
  118 8 8
  133 16 16
  136 8 8
  141 8 8
  147 102 102
  159 8 8
  161 12 12
  180 31 31
  191 20 20
  200 8 8
  201 12 12
  205 8 8
  234 110 110
  235 24 24
  249 208 208
  250 31 31
  278 999 999
  279 204 204
  280 20 20
//