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MassBank Record: WA002266

EDDP; LC-ESI-Q; MS; POS; 60 V

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

ACCESSION: WA002266
RECORD_TITLE: EDDP; LC-ESI-Q; MS; POS; 60 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 60 V

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

PK$SPLASH: splash10-001i-0190000000-ee944dc9f56ffdd66271
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  101 24 24
  103 67 67
  117 12 12
  118 16 16
  120 12 12
  128 8 8
  136 35 35
  147 39 39
  158 12 12
  161 8 8
  171 12 12
  172 39 39
  180 16 16
  187 8 8
  200 47 47
  201 78 78
  202 8 8
  207 16 16
  221 8 8
  234 999 999
  235 188 188
  248 47 47
  249 443 443
  250 8 8
  278 407 407
  279 86 86
//

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