ACCESSION: MSBNK-EPA-ENTACT_AGILENT001724
RECORD_TITLE: Cyanoguanidine; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Cyanoguanidine
CH$NAME: DTXSID1020354
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂H₄N₄
CH$EXACT_MASS: 84.0435961572
CH$SMILES: NC(=N)NC#N
CH$IUPAC: InChI=1S/C2H4N4/c3-1-6-2(4)5/h(H4,4,5,6)
CH$LINK: CAS 461-58-5
CH$LINK: INCHIKEY QGBSISYHAICWAH-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:10005

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$FOCUSED_ION: PRECURSOR_M/Z 85.0508726089
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00ku-9000000000-07a258ea4964ed7d1f8b
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  43.029075 55.130577 550
  68.024324 97.634535 975
  85.050873 100.000001 999
//