MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008247
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008247
RECORD_TITLE: DIMETHYL MALEATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
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$LINK: CAS
624-48-6
CH$LINK: INCHIKEY
LDCRTTXIJACKKU-ARJAWSKDSA-N
CH$LINK: COMPTOX
DTXSID4040765
AC$INSTRUMENT: HITACHI M-60
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: splash10-03di-9800000000-9b43ca980ebe24e7dd08
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
15 28.11 281
26 10.48 105
27 3.21 32
28 1.68 17
29 4.91 49
30 1.36 14
31 1.34 13
32 1 10
39 1.97 20
41 1.1 11
42 1.16 12
45 1.03 10
53 4.21 42
54 6.82 68
55 4.28 43
57 1.25 13
59 26.36 264
82 2.83 28
85 8.92 89
113 99.99 999
114 8.49 85
115 1.7 17
144 0.71 7
//
system version 2.2.6-SNAPSHOT