MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006920
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006920
RECORD_TITLE: TETRAHYDROFURFURYL PROPIONATE; 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$NAME: TETRAHYDROFURFURYL PROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H14O3
CH$EXACT_MASS: 158.09429
CH$SMILES: CCC(=O)OCC(C1)OCC1
CH$IUPAC: InChI=1S/C8H14O3/c1-2-8(9)11-6-7-4-3-5-10-7/h7H,2-6H2,1H3
CH$LINK: INCHIKEY
FMKCDSXOYLTWBR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID90862336
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$SPLASH: splash10-00di-9000000000-32e9a1d39997c3b8db61
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
15 1.61 16
26 1.69 17
27 16.16 162
28 2.05 21
29 24.53 245
31 2.38 24
39 6.15 62
40 1.11 11
41 12.98 130
42 6.72 67
43 35.54 355
44 1.15 12
54 1.47 15
55 2.73 27
56 1.76 18
57 22.45 225
70 1.67 17
71 99.99 999
72 4.02 40
84 11.36 114
//