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MassBank Record: MSBNK-EPA-ENTACT_AGILENT002217

Benzyltriethylammonium; 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_AGILENT002217
RECORD_TITLE: Benzyltriethylammonium; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Benzyltriethylammonium
CH$NAME: DTXSID9021710
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H22N+
CH$EXACT_MASS: 192.1752247092
CH$SMILES: CC[N+](CC1C=CC=CC=1)(CC)CC
CH$IUPAC: InChI=1S/C13H22N/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3/q+1
CH$LINK: CAS 16652-03-2
CH$LINK: INCHIKEY VBQDSLGFSUGBBE-UHFFFAOYSA-N

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$FOCUSED_ION: PRECURSOR_M/Z 193.1825011609
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-2900000000-530cb88685168d8d614f
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  86.096426 2.460973 24
  87.104251 1.267964 12
  91.054227 15.835199 158
  92.062052 15.862942 158
  100.112076 9.710271 97
  101.119901 8.910558 89
  193.182501 100.000003 999
//

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