MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000198
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000198
RECORD_TITLE: META METHYL ACETOPHENONE; 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$NAME: META METHYL ACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O
CH$EXACT_MASS: 134.07316
CH$SMILES: CC(=O)c(c1)cc(C)cc1
CH$IUPAC: InChI=1S/C9H10O/c1-7-4-3-5-9(6-7)8(2)10/h3-6H,1-2H3
CH$LINK: INCHIKEY
FSPSELPMWGWDRY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5074717
AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-014l-9500000000-f41b64d8b52865da17a7
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
15 4.03 40
27 3.15 32
38 3.06 31
39 21.37 214
41 4.76 48
43 24.11 241
45.5 2.34 23
50 5.4 54
51 9.52 95
52 2.02 20
62 4.03 40
63 11.94 119
64 2.82 28
65 31.85 319
66 1.61 16
77 2.42 24
89 5.65 57
90 2.42 24
91 82.5 825
92 6.45 65
119 99.99 999
120 8.55 86
134 31.21 312
135 3.23 32
//