ACCESSION: MSBNK-EPA-ENTACT_AGILENT001690
RECORD_TITLE: 3-Pyridinamine; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-Pyridinamine
CH$NAME: DTXSID9047461
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₆N₂
CH$EXACT_MASS: 94.0530982062
CH$SMILES: NC1=CN=CC=C1
CH$IUPAC: InChI=1S/C5H6N2/c6-5-2-1-3-7-4-5/h1-4H,6H2
CH$LINK: CAS 462-08-8
CH$LINK: INCHIKEY CUYKNJBYIJFRCU-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:10009

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$FOCUSED_ION: PRECURSOR_M/Z 95.0603746579
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0002-9000000000-9be73a7bc72fc2d8f256
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  41.038577 9.982212 99
  42.033826 1.502574 15
  51.022927 2.330248 23
  52.018175 1.413428 14
  68.049476 43.88767 438
  78.033826 32.3003 322
  95.060375 99.999999 999
//