MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000199
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000199
RECORD_TITLE: PARA 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$NAME: PARA METHYL ACETOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O
CH$EXACT_MASS: 134.07316
CH$SMILES: Cc(c1)ccc(c1)C(C)=O
CH$IUPAC: InChI=1S/C9H10O/c1-7-3-5-9(6-4-7)8(2)10/h3-6H,1-2H3
CH$LINK: INCHIKEY
GNKZMNRKLCTJAY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9044374
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$SPLASH: splash10-014l-9600000000-a92d1697dd1d26696edf
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
15 1.73 17
27 2 20
38 1.46 15
39 11.98 120
41 3.66 37
43 10.79 108
45.5 1.46 15
50 3.6 36
51 6.06 61
62 2.86 29
63 7.99 80
64 1.86 19
65 24.23 242
66 1.46 15
77 2.8 28
89 6.66 67
90 3.06 31
91 85.89 859
92 6.86 69
119 99.99 999
120 8.66 87
134 22.5 225
135 2.2 22
//
system version 2.2.6-SNAPSHOT