MassBank Record: MSBNK-EPA-ENTACT_AGILENT001044

4-Amino-1,2,4-triazole; ESI-QTOF; MS2; CE: 20; [M-H]-

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT001044
RECORD_TITLE: 4-Amino-1,2,4-triazole; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

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CH$NAME: 4-Amino-1,2,4-triazole
CH$NAME: DTXSID9033058
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂H₄N₄
CH$EXACT_MASS: 84.0435961572
CH$SMILES: NN1C=NN=C1
CH$IUPAC: InChI=1S/C2H4N4/c3-6-1-4-5-2-6/h1-2H,3H2
CH$LINK: CAS 584-13-4
CH$LINK: INCHIKEY FMCUPJKTGNBGEC-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:11432

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AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

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MS$FOCUSED_ION: PRECURSOR_M/Z 83.0363197055
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-014i-9000000000-58530242bc103fd2408f
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  40.006697 1.898078 18
  41.014522 4.717344 47
  68.025421 99.999999 999
  83.03632 1.331851 13
//