ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008194
RECORD_TITLE: GLYCINE ANHYDRIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: GLYCINE ANHYDRIDE
CH$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$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-03ec-9300000000-ee68a54cdab383a6aa11
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 2.59 26
  26 1.01 10
  27 9.65 97
  29 40.51 405
  30 90.54 905
  31 1.92 19
  42 2.25 23
  43 34.69 347
  44 35.86 359
  45 2.33 23
  55 1.85 19
  56 5.83 58
  57 1.67 17
  58 4.28 43
  59 2.49 25
  71 45.59 456
  72 2.24 22
  85 1.28 13
  86 8.37 84
  114 99.99 999
  115 6.42 64
//