MassBank Record: MSBNK-EPA-ENTACT_AGILENT001504

1,3-Benzenedicarboxylic acid, dihydrazide; ESI-QTOF; MS2; CE: 40; [M-H]-

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT001504
RECORD_TITLE: 1,3-Benzenedicarboxylic acid, dihydrazide; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

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CH$NAME: 1,3-Benzenedicarboxylic acid, dihydrazide
CH$NAME: DTXSID2038813
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀N₄O₂
CH$EXACT_MASS: 194.0803755932
CH$SMILES: NNC(=O)C1=CC(=CC=C1)C(=O)NN
CH$IUPAC: InChI=1S/C8H10N4O2/c9-11-7(13)5-2-1-3-6(4-5)8(14)12-10/h1-4H,9-10H2,(H,11,13)(H,12,14)
CH$LINK: CAS 2760-98-7
CH$LINK: INCHIKEY UTTHLMXOSUFZCQ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:72700

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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 40

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MS$FOCUSED_ION: PRECURSOR_M/Z 193.0730991415
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-0006-9000000000-c5f06b34fce95a6aff93
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  41.998537 99.999997 999
  42.022347 2.189924 21
  42.034923 1.288323 12
  57.009436 2.018823 20
  76.031849 1.147348 11
//