MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001295
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001295
RECORD_TITLE: OXALIC ACID DIBUTYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: OXALIC ACID DIBUTYL ESTER
CH$NAME: ETHANEDIOIC ACID DIBUTYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O4
CH$EXACT_MASS: 202.12051
CH$SMILES: CCCCOC(=O)C(=O)OCCCC
CH$IUPAC: InChI=1S/C10H18O4/c1-3-5-7-13-9(11)10(12)14-8-6-4-2/h3-8H2,1-2H3
CH$LINK: INCHIKEY
JKRZOJADNVOXPM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7041916
AC$INSTRUMENT: HITACHI RMU-7M
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: splash10-0a4i-9000000000-1cebf8deb4734cf3a291
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
27 9.09 91
28 5.31 53
29 43.19 432
30 1.3 13
31 5.49 55
39 4.72 47
40 1 10
41 49.26 493
42 3.83 38
43 5.78 58
44 2.54 25
55 6.73 67
56 26.72 267
57 99.99 999
58 4.25 43
73 1 10
//