MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007754
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007754
RECORD_TITLE: ISOPENTYL 2-FURYLPROPIONATE; 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$NAME: ISOPENTYL 2-FURYLPROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H18O3
CH$EXACT_MASS: 210.12559
CH$SMILES: CC(C)CCOC(=O)C(C)c(c1)occ1
CH$IUPAC: InChI=1S/C12H18O3/c1-9(2)6-8-15-12(13)10(3)11-5-4-7-14-11/h4-5,7,9-10H,6,8H2,1-3H3
CH$LINK: INCHIKEY
RPMOJCVAPZDVNG-UHFFFAOYSA-N
AC$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: splash10-0006-9200000000-59d55fbac607ddd8c2df
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
29 2.12 21
41 5.84 58
42 2.06 21
43 99.99 999
44 4.53 45
53 1.76 18
54 1.74 17
55 17.35 174
67 8.12 81
68 8.12 81
69 6.75 68
70 6.66 67
71 63.56 636
72 5.01 50
81 60.94 609
82 12.31 123
94 65.08 651
95 24.45 245
96 4.24 42
97 31.25 313
98 1.98 20
123 21.8 218
124 5.29 53
139 21.76 218
140 46.27 463
141 9.54 95
142 6.36 64
153 1.03 10
210 23.44 234
211 6.34 63
//