MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007064
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007064
RECORD_TITLE: ETHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: ETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8O2
CH$EXACT_MASS: 88.05243
CH$SMILES: CCOC(C)=O
CH$IUPAC: InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
CH$LINK: CAS
141-78-6
CH$LINK: INCHIKEY
XEKOWRVHYACXOJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1022001
AC$INSTRUMENT: HITACHI M-80B
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: splash10-0006-9000000000-6209b0c76b2469152461
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
14 1.72 17
15 8.98 90
26 2.32 23
27 10.2 102
28 2.08 21
29 15.74 157
30 1.04 10
31 1.01 10
42 5.95 60
43 99.99 999
44 2.57 26
45 13.08 131
61 12.68 127
70 7.38 74
73 4.55 46
88 5.1 51
//