ACCESSION: MSBNK-EPA-ENTACT_AGILENT000687
RECORD_TITLE: 3,4-Diaminotoluene; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3,4-Diaminotoluene
CH$NAME: DTXSID9024930
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₀N₂
CH$EXACT_MASS: 122.0843983338
CH$SMILES: CC1C=C(N)C(N)=CC=1
CH$IUPAC: InChI=1S/C7H10N2/c1-5-2-3-6(8)7(9)4-5/h2-4H,8-9H2,1H3
CH$LINK: CAS 496-72-0
CH$LINK: INCHIKEY DGRGLKZMKWPMOH-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:10332

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$FOCUSED_ION: PRECURSOR_M/Z 123.0916747855
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-05fr-1900000000-c7be4c2ec75c9ea4644a
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  77.038577 4.503827 44
  79.054227 14.180794 141
  106.065126 57.696927 576
  108.0682 6.383076 63
  123.091675 99.999997 999
//