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MassBank Record: MSBNK-EPA-ENTACT_AGILENT001992

4-(Diethylamino)salicylaldehyde; ESI-QTOF; MS2; CE: 10; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT001992
RECORD_TITLE: 4-(Diethylamino)salicylaldehyde; ESI-QTOF; MS2; CE: 10; [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 POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10

MS$FOCUSED_ION: PRECURSOR_M/Z 194.1175551822
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-0900000000-4ae33b8b9878b26d9952
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  165.07843 1.066905 10
  166.086255 2.865979 28
  166.122641 3.301164 32
  194.117555 100 999
//

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