ACCESSION: MSBNK-EPA-ENTACT_AGILENT002501
RECORD_TITLE: Hexanedihydrazide; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Hexanedihydrazide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄N₄O₂
CH$EXACT_MASS: 174.1116757208
CH$SMILES: NNC(=O)CCCCC(=O)NN
CH$IUPAC: InChI=1S/C6H14N4O2/c7-9-5(11)3-1-2-4-6(12)10-8/h1-4,7-8H2,(H,9,11)(H,10,12)
CH$LINK: CAS 1071-93-8
CH$LINK: INCHIKEY IBVAQQYNSHJXBV-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:66117

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 10

MS$FOCUSED_ION: PRECURSOR_M/Z 173.1043992691
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001i-9400000000-5a83cf31d75a8f65cf38
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  41.998537 12.142257 121
  57.009436 18.647921 186
  59.013853 1.468231 14
  73.040736 2.008315 20
  81.034588 2.825965 28
  83.050238 100 999
  83.086624 1.60811 16
  115.087687 2.163495 21
  123.056386 3.709908 37
  127.087687 1.43035 14
  141.066951 23.770934 237
  173.104399 31.596255 315
//