MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002132
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002132
RECORD_TITLE: ISOPROPYL METHACRYLATE (1,1,1-D3); 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$NAME: ISOPROPYL METHACRYLATE (1,1,1-D3)
CH$NAME: METHACRYLIC ACID ISOPROPYL ESTER (1,1,1-D3)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H12O2
CH$EXACT_MASS: 128.08373
CH$SMILES: [2H]C([2H])([2H])C(C)OC(=O)C(C)=C
CH$IUPAC: InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3/i3D3
CH$LINK: INCHIKEY
BOQSSGDQNWEFSX-HPRDVNIFSA-N
AC$INSTRUMENT: HITACHI RMU-5B
AC$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$SPLASH: splash10-00kp-9000000000-758b3869a90cad776a77
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
26 2.98 30
27 8.95 90
28 5.96 60
29 10.93 109
37 3.88 39
38 7.75 78
39 49.9 499
40 15.71 157
41 82.7 827
42 12.72 127
43 20.78 208
44 14.12 141
45 10.93 109
46 90.46 905
47 2.78 28
48 2.58 26
53 1.99 20
55 1.89 19
62 19.88 199
67 3.88 39
68 1.99 20
69 99.99 999
70 9.64 96
73 9.34 93
85 1.99 20
86 8.35 84
87 3.38 34
88 30.02 300
89 1.79 18
95 1.79 18
113 1.09 11
116 1.19 12
131 2.98 30
//