ACCESSION: MSBNK-EPA-ENTACT_AGILENT001149
RECORD_TITLE: 2-Amino-6-hydroxy-1H-pyrimidin-4-one; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Amino-6-hydroxy-1H-pyrimidin-4-one
CH$NAME: DTXSID3052222
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₅N₃O₂
CH$EXACT_MASS: 127.0381764263
CH$SMILES: NC1NC(=O)CC(=O)N=1
CH$IUPAC: InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H2,(H3,5,6,7,8,9)
CH$LINK: CAS 56-09-7
CH$LINK: INCHIKEY BTYNVOQLMBUUMS-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:78146

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$FOCUSED_ION: PRECURSOR_M/Z 126.0308999746
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-003u-9300000000-daa578cc5bd430857412
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  40.019273 20.851582 208
  41.003288 1.660476 16
  41.014522 43.107224 430
  41.998537 9.644843 96
  58.041071 5.902205 58
  82.041071 99.999996 999
  83.025086 23.345146 233
  84.009102 5.219915 52
  109.004351 2.226156 22
  126.0309 90.302315 902
//