MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005430
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005430
RECORD_TITLE: 1,2-DIACETOXYETHANE; 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$NAME: 1,2-DIACETOXYETHANE
CH$NAME: ETHYLENEGLYCOL DIACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H10O4
CH$EXACT_MASS: 146.05791
CH$SMILES: CC(=O)OCCOC(C)=O
CH$IUPAC: InChI=1S/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H3
CH$LINK: INCHIKEY
JTXMVXSTHSMVQF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0026880
AC$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: splash10-0006-9000000000-8667267aab52464c5b23
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
15 4.43 44
42 1.94 19
43 99.99 999
44 2.91 29
73 5.22 52
74 1.7 17
86 12.31 123
87 3.58 36
103 2.3 23
116 4.79 48
//