ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007621
RECORD_TITLE: 2,5-PIPERAZINEDIONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 2,5-PIPERAZINEDIONE
CH$NAME: CYCLOGLYCYLGLYCINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H6N2O2
CH$EXACT_MASS: 114.04293
CH$SMILES: O=C(C1)NCC(=O)N1
CH$IUPAC: InChI=1S/C4H6N2O2/c7-3-1-5-4(8)2-6-3/h1-2H2,(H,5,8)(H,6,7)
CH$LINK: CAS 106-57-0
CH$LINK: INCHIKEY BXRNXXXXHLBUKK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8059342
AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 15 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03k9-9500000000-45bb89decb9d3b9486da
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  29 3 30
  30 44.2 442
  31 1.2 12
  42 0.48 5
  43 45.2 452
  44 1.4 14
  57 1.2 12
  58 0.39 4
  71 74.7 747
  72 3.4 34
  85 1.2 12
  86 1.26 13
  114 99.99 999
  115 6.4 64
//
