MassBank Record: JP002926



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

ACCESSION: JP002926
RECORD_TITLE: DIMETHYL FUMARATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: DIMETHYL FUMARATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H8O4 CH$EXACT_MASS: 144.04226 CH$SMILES: COC(=O)C=CC(=O)OC CH$IUPAC: InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03di-9500000000-ef1a2c817c752048ca3d PK$NUM_PEAK: 19 PK$PEAK: m/z int. rel.int. 15 39.31 393 26 15.81 158 27 4.5 45 29 9.27 93 31 2.35 24 39 5.02 50 41 3.91 39 53 14.78 148 54 11.13 111 55 3.21 32 59 30.99 310 81 4.18 42 82 6.24 62 85 48.47 485 86 2.43 24 100 2.46 25 113 99.99 999 114 19.52 195 144 2.57 26 //