ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007619
RECORD_TITLE: 3-ISOPROPYL-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$NAME: 3-ISOPROPYL-2,5-PIPERAZINEDIONE
CH$NAME: CYCLOGLYCYLVALINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H12N2O2
CH$EXACT_MASS: 156.08988
CH$SMILES: CC(C)C(N1)C(=O)NCC(=O)1
CH$IUPAC: InChI=1S/C7H12N2O2/c1-4(2)6-7(11)8-3-5(10)9-6/h4,6H,3H2,1-2H3,(H,8,11)(H,9,10)
CH$LINK: INCHIKEY IULFBTHVPRNQCG-UHFFFAOYSA-N
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$SPLASH: splash10-03di-2900000000-4b01b61e2e21f2b3802b
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  30 12.2 122
  42 1.2 12
  43 1.9 19
  56 0.13 1
  57 4.8 48
  70 7.7 77
  71 1.4 14
  72 0.15 2
  86 4.5 45
  113 13.5 135
  114 99.99 999
  115 0.59 6
  141 1.3 13
  156 0.8 8
//
