MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011803
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011803
RECORD_TITLE: 4-METHOXYACETOPHENONE (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$NAME: 4-METHOXYACETOPHENONE (D3)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O2
CH$EXACT_MASS: 150.06808
CH$SMILES: [2H]C([2H])([2H])Oc(c1)ccc(c1)C(C)=O
CH$IUPAC: InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3/i2D3
CH$LINK: INCHIKEY
NTPLXRHDUXRPNE-BMSJAHLVSA-N
CH$LINK: PUBCHEM
CID:102064511
AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-000i-9800000000-b943a08390f9ab22ada1
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
15 2.68 27
18 3.62 36
37 1.09 11
38 4.65 47
39 4.43 44
42 1.81 18
43 15.74 157
50 5.85 59
51 5.2 52
52 2.91 29
53 1.56 16
61 1.29 13
62 4.13 41
63 14.32 143
64 15.29 153
65 2.79 28
66 1.05 11
74 2.46 25
75 1.74 17
76 2.25 23
77 4.08 41
78 25.46 255
79 6.98 70
80 3.09 31
82 1.59 16
92 25.69 257
93 2.09 21
110 10.23 102
120 1.81 18
124 1.19 12
138 99.99 999
139 9.14 91
153 33.84 338
154 3.6 36
//