ACCESSION: MSBNK-EPA-ENTACT_AGILENT001996
RECORD_TITLE: 4-(Diethylamino)salicylaldehyde; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4-(Diethylamino)salicylaldehyde
CH$NAME: DTXSID5022271
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₅NO₂
CH$EXACT_MASS: 193.1102787305
CH$SMILES: CCN(CC)C1C=C(O)C(C=O)=CC=1
CH$IUPAC: InChI=1S/C11H15NO2/c1-3-12(4-2)10-6-5-9(8-13)11(14)7-10/h5-8,14H,3-4H2,1-2H3
CH$LINK: CAS 17754-90-4
CH$LINK: INCHIKEY XFVZSRRZZNLWBW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:87293

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 192.1030022788
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00di-2900000000-3341e048c781f3f65dce
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  41.003288 1.172745 11
  65.039674 1.782171 17
  66.034923 1.301101 12
  92.014187 1.409783 14
  92.026763 4.942467 49
  93.034588 19.570016 195
  107.037662 1.185608 11
  108.045487 1.980794 19
  118.029837 4.319927 43
  119.050238 1.408228 14
  120.045487 100.000001 999
  120.081873 2.155051 21
  134.061137 4.590219 45
  148.040402 3.109664 31
//