MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007749
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007749
RECORD_TITLE: ISOPENTYL 2-FUROATE; 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$NAME: ISOPENTYL 2-FUROATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H14O3
CH$EXACT_MASS: 182.09429
CH$SMILES: CC(C)CCOC(=O)c(c1)occ1
CH$IUPAC: InChI=1S/C10H14O3/c1-8(2)5-7-13-10(11)9-4-3-6-12-9/h3-4,6,8H,5,7H2,1-2H3
CH$LINK: INCHIKEY
FPBZWZKAUPNMMV-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID20210467
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$SPLASH: splash10-05fv-9100000000-0b7ffb243b20f03f28ce
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
29 6.75 68
39 12.35 124
41 13.16 132
42 31.24 312
43 41.61 416
55 68.43 684
56 3.18 32
57 2.06 21
68 7.57 76
69 12.82 128
70 99.99 999
71 11.73 117
84 2.16 22
95 68.36 684
96 9.54 95
112 44.22 442
139 1.96 20
182 1.01 10
//