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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000713

N-Ethyl-3-methylaniline; ESI-QTOF; MS2; CE: 20; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000713
RECORD_TITLE: N-Ethyl-3-methylaniline; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N-Ethyl-3-methylaniline
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H13N
CH$EXACT_MASS: 135.1047994221
CH$SMILES: CC1C=C(C=CC=1)NCC
CH$IUPAC: InChI=1S/C9H13N/c1-3-10-9-6-4-5-8(2)7-9/h4-7,10H,3H2,1-2H3
CH$LINK: CAS 102-27-2
CH$LINK: INCHIKEY GUYMMHOQXYZMJQ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7603

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 136.1120758738
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a4i-0900000000-62b047eec6d383255039
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  79.054227 1.595624 15
  91.054227 5.041568 50
  93.057301 8.2708 82
  106.065126 25.378537 253
  107.072951 100.000001 999
  108.080776 24.635063 246
  121.088601 3.353537 33
  134.096426 1.482293 14
  136.112076 3.945267 39
//

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