MassBank Record: JP000332



 COBALT TRIACETYLATONATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000332
RECORD_TITLE: COBALT TRIACETYLATONATE; 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$NAME: COBALT TRIACETYLATONATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H21CoO6 CH$EXACT_MASS: 356.06701 CH$SMILES: CC(=O)C=C(C)O[Co](OC(C)=CC(C)=O)OC(C)=CC(C)=O CH$IUPAC: InChI=1S/3C5H8O2.Co/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3/b2*4-3+;4-3-;
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$SPLASH: splash10-0006-9020000000-9c17df14ebe6aa07f78c PK$NUM_PEAK: 64 PK$PEAK: m/z int. rel.int. 14 1.5 15 15 9 90 17 0.5 5 18 0.35 4 26 2 20 27 7 70 28 10 100 29 0.45 5 31 3.5 35 37 0.5 5 38 1.3 13 39 0.06 1 40 0.7 7 41 6.3 63 42 6.5 65 43 99.99 999 44 5.5 55 45 0.7 7 50 0.5 5 51 0.05 1 52 0.2 2 53 1 10 55 2.5 25 57 0.07 1 58 3.5 35 59 5.3 53 60 0.5 5 67 0.06 1 69 1 10 72 4 40 73 0.5 5 74 0.05 1 76 0.5 5 78 1.5 15 85 40.3 403 86 0.15 2 87 3 30 98 0.5 5 99 0.3 3 100 0.29 3 101 1.5 15 113 0.5 5 115 2.5 25 129 0.01 0 131 0.5 5 140 0.5 5 141 0.5 5 142 0.15 2 143 5 50 151 1.8 18 155 2 20 158 0.4 4 159 4 40 200 0.5 5 215 0.5 5 225 0.37 4 240 0.5 5 242 29 290 243 2.5 25 250 0.43 4 251 0.7 7 253 0.7 7 257 24.5 245 258 3 30 //