MassBank Record: MSBNK-EPA-ENTACT_AGILENT001347
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001347
RECORD_TITLE: 1H-1,2,4-Triazole; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 1H-1,2,4-Triazole
CH$NAME: DTXSID6027131
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C2H3N3
CH$EXACT_MASS: 69.0326971179
CH$SMILES: C1=NNC=N1
CH$IUPAC: InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)
CH$LINK: CAS
288-88-0
CH$LINK: INCHIKEY
NSPMIYGKQJPBQR-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:9257
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$FOCUSED_ION: PRECURSOR_M/Z 70.0399735696
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-00di-9000000000-541ef80ce3eb0a4d24f7
PK$NUM_PEAK: 2
PK$PEAK: m/z int. rel.int.
43.029075 3.200983 31
70.039974 100.000002 999
//