MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002927
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002927
RECORD_TITLE: DIMETHYL MALEATE; 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$NAME: DIMETHYL MALEATE
CH$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-
CH$LINK: INCHIKEY
LDCRTTXIJACKKU-ARJAWSKDSA-N
CH$LINK: COMPTOX
DTXSID4040765
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-8900000000-cf4bc8e74198c9d1fbe2
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
15 28.11 281
26 10.48 105
27 3.21 32
29 4.91 49
53 4.21 42
54 6.82 68
55 4.28 43
59 26.36 264
82 2.83 28
85 8.92 89
113 99.99 999
114 8.49 85
//