MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007444
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007444
RECORD_TITLE: 2-(2-ETHOXYETHOXY)ETHYL ACETATE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 2-(2-ETHOXYETHOXY)ETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H16O4
CH$EXACT_MASS: 176.10486
CH$SMILES: CCOCCOCCOC(C)=O
CH$IUPAC: InChI=1S/C8H16O4/c1-3-10-4-5-11-6-7-12-8(2)9/h3-7H2,1-2H3
CH$LINK: CAS
112-15-2
CH$LINK: INCHIKEY
FPZWZCWUIYYYBU-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6026905
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE
PK$SPLASH: splash10-004i-0900000000-87e0ff43774f49e17168
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
66 1.77 18
72 1.84 18
75 0.56 6
77 0.96 10
87 1.02 10
96 0.58 6
98 0.56 6
117 1.19 12
125 0.77 8
135 0.79 8
137 0.65 7
143 0.62 6
163 0.75 8
175 0.93 9
177 99.99 999
178 10.47 105
215 0.59 6
//