MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002538
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002538
RECORD_TITLE: ISOBUTYL ACRYLATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ISOBUTYL ACRYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H12O2
CH$EXACT_MASS: 128.08373
CH$SMILES: C=CC(=O)OCC(C)C
CH$IUPAC: InChI=1S/C7H12O2/c1-4-7(8)9-5-6(2)3/h4,6H,1,5H2,2-3H3
CH$LINK: INCHIKEY
CFVWNXQPGQOHRJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1021873
AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0a4i-9000000000-5263f0854392861d6801
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
15 1.03 10
26 2.95 30
27 24.63 246
28 2.95 30
29 7.41 74
31 1.77 18
39 5.23 52
40 1.09 11
41 13.82 138
42 2.15 22
43 5.22 52
55 99.99 999
56 55.02 550
57 5.67 57
69 1.97 20
70 2.45 25
73 11.13 111
85 9.3 93
//