ACCESSION: MSBNK-EPA-ENTACT_AGILENT002017
RECORD_TITLE: 3'-Methyl-4-dimethylaminoazobenzene; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3'-Methyl-4-dimethylaminoazobenzene
CH$NAME: DTXSID8020838
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₇N₃
CH$EXACT_MASS: 239.1422475645
CH$SMILES: CC1C=CC=C(C=1)/N=N/C1C=CC(=CC=1)N(C)C
CH$IUPAC: InChI=1S/C15H17N3/c1-12-5-4-6-14(11-12)17-16-13-7-9-15(10-8-13)18(2)3/h4-11H,1-3H3/b17-16+
CH$LINK: CAS 55-80-1
CH$LINK: INCHIKEY LVTFSVIRYMXRSR-WUKNDPDISA-N
CH$LINK: PUBCHEM CID:5934

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$FOCUSED_ION: PRECURSOR_M/Z 240.1495240162
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-1090000000-5a73b814e31926c6f381
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  91.054227 16.576429 165
  92.062052 1.089195 10
  120.080776 1.123008 11
  121.088601 1.544678 15
  240.149524 100.000002 999
//