ACCESSION: MSBNK-Waters-WA001930
RECORD_TITLE: Diethylpropin; LC-ESI-Q; MS; POS; 30 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Diethylpropin
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₉NO
CH$EXACT_MASS: 205.14666
CH$SMILES: CCN(CC)C(C)C(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C13H19NO/c1-4-14(5-2)11(3)13(15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3
CH$LINK: CAS 90-84-6
CH$LINK: INCHIKEY XXEPPPIWZFICOJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6022929

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 10.700 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 30 V

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

PK$SPLASH: splash10-0a4i-0390000000-b660b112a2e4dc30250c
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  100 67 67
  101 16 16
  102 31 31
  105 114 114
  133 188 188
  134 16 16
  160 12 12
  188 27 27
  206 999 999
  207 153 153
  208 12 12
//