ACCESSION: MSBNK-EPA-ENTACT_AGILENT000813
RECORD_TITLE: N,N-Dimethylacetoacetamide; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N,N-Dimethylacetoacetamide
CH$NAME: DTXSID8027454
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₁NO₂
CH$EXACT_MASS: 129.0789786029
CH$SMILES: CC(=O)CC(=O)N(C)C
CH$IUPAC: InChI=1S/C6H11NO2/c1-5(8)4-6(9)7(2)3/h4H2,1-3H3
CH$LINK: CAS 2044-64-6
CH$LINK: INCHIKEY YPEWWOUWRRQBAX-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:16278

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$FOCUSED_ION: PRECURSOR_M/Z 130.0862550546
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-008a-9300000000-257dd612c2dffcbb764d
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  41.038577 1.083929 10
  43.017841 33.843884 338
  43.041651 1.064612 10
  46.065126 83.032615 829
  57.069877 1.861809 18
  72.04439 89.27804 891
  74.096426 2.052553 20
  85.028406 10.200366 101
  85.064791 2.324559 23
  88.07569 1.096031 10
  130.086255 99.999996 999
//