MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006463
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006463
RECORD_TITLE: ISOBUTYL FORMATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ISOBUTYL FORMATE
CH$NAME: 2-METHYLPROPYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10O2
CH$EXACT_MASS: 102.06808
CH$SMILES: O=COCC(C)C
CH$IUPAC: InChI=1S/C5H10O2/c1-5(2)3-7-4-6/h4-5H,3H2,1-2H3
CH$LINK: INCHIKEY
AVMSWPWPYJVYKY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7060257
AC$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: splash10-052f-9000000000-20bd4fc945c5dd133050
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
26 2.09 21
27 29.62 296
28 5.34 53
29 28.33 283
30 1.32 13
31 46.37 464
32 4.44 44
33 1.03 10
38 2.28 23
40 4.84 48
41 71.23 712
42 20.23 202
43 93.52 935
44 3.22 32
45 2.01 20
53 1.31 13
55 8.19 82
56 99.99 999
57 9.93 99
59 8.5 85
60 46.94 469
61 13.47 135
73 1.41 14
//