ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000333
RECORD_TITLE: NICKEL DIACETYLACETONATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: NICKEL DIACETYLACETONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄NiO₄
CH$EXACT_MASS: 256.02456
CH$SMILES: CC(=O)C=C(C)O[Ni]OC(C)=CC(C)=O
CH$IUPAC: InChI=1S/2C5H8O2.Ni/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;;+2/p-2/b2*4-3-;
CH$LINK: INCHIKEY BMGNSKKZFQMGDH-FDGPNNRMSA-L
CH$LINK: COMPTOX DTXSID80904370

AC$INSTRUMENT: HITACHI RMU-6D
AC$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$SPLASH: splash10-014l-9000000000-11f7cdf784393a8fe234
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  12 0.3 3
  13 0.4 4
  14 2 20
  15 1.2 12
  16 3 30
  17 45 450
  18 99.99 999
  26 0.13 1
  27 5 50
  28 32 320
  29 19.3 193
  30 0.02 0
  31 31.3 313
  32 21 210
  36 0.3 3
  37 0.07 1
  38 1 10
  39 4 40
  41 5 50
  42 0.67 7
  43 80 800
  44 8 80
  50 0.3 3
  55 0.02 0
  56 0.3 3
  57 1 10
  58 2.3 23
  69 0.03 0
  71 2.3 23
  85 32 320
  100 22 220
  101 1 10
//