MassBank Record: MSBNK-EPA-ENTACT_AGILENT001311
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001311
RECORD_TITLE: 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one
CH$NAME: DTXSID1044934
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10N2O3
CH$EXACT_MASS: 146.0691422007
CH$SMILES: CN1C(O)C(O)N(C)C1=O
CH$IUPAC: InChI=1S/C5H10N2O3/c1-6-3(8)4(9)7(2)5(6)10/h3-4,8-9H,1-2H3
CH$LINK: CAS
3923-79-3
CH$LINK: INCHIKEY
LGJMYGMNWHYGCB-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:73539
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$FOCUSED_ION: PRECURSOR_M/Z 145.061865749
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-000i-9000000000-3c2e0c6c619fb09ffa79
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
56.014187 9.990736 99
56.998203 2.076602 20
58.029837 2.225042 22
60.993117 1.512294 15
86.024752 5.432116 54
87.056386 99.999999 999
88.040402 38.956738 389
//