MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006173
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006173
RECORD_TITLE: ETHYLENE GLYCOL MONOACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: ETHYLENE GLYCOL MONOACETATE
CH$NAME: 2-HYDROXYETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8O3
CH$EXACT_MASS: 104.04734
CH$SMILES: OCCOC(C)=O
CH$IUPAC: InChI=1S/C4H8O3/c1-4(6)7-3-2-5/h5H,2-3H2,1H3
CH$LINK: INCHIKEY
HXDLWJWIAHWIKI-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID10862156
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9000000000-9512bf0850cbc723990c
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
18 1.14 11
29 2.14 21
31 8.58 86
42 2.28 23
43 99.99 999
44 12.95 130
45 7.84 78
61 11.28 113
73 18.25 183
74 26.02 260
76 1.29 13
104 0.18 2
//