MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009049
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009049
RECORD_TITLE: ETHYL 2-FUROATE; 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$NAME: ETHYL 2-FUROATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H8O3
CH$EXACT_MASS: 140.04734
CH$SMILES: CCOC(=O)c(c1)occ1
CH$IUPAC: InChI=1S/C7H8O3/c1-2-9-7(8)6-4-3-5-10-6/h3-5H,2H2,1H3
CH$LINK: CAS
614-99-3
CH$LINK: INCHIKEY
NHXSTXWKZVAVOQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0060640
AC$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: splash10-0002-9200000000-5c100f35c0f33369946d
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
26 1.7 17
27 7.41 74
29 8.47 85
37 2.7 27
38 8.22 82
39 25.04 250
41 1.11 11
42 1.03 10
45 4.49 45
53 1.33 13
66 1.19 12
67 2.23 22
68 10.31 103
84 2.63 26
95 99.99 999
96 17.07 171
97 1.79 18
112 40.8 408
113 2.42 24
140 18.31 183
141 1.25 13
//