MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007223
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007223
RECORD_TITLE: P-DIMETHOXYBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: P-DIMETHOXYBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O2
CH$EXACT_MASS: 138.06808
CH$SMILES: COc(c1)ccc(OC)c1
CH$IUPAC: InChI=1S/C8H10O2/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H3
CH$LINK: INCHIKEY
OHBQPCCCRFSCAX-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0022014
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-00dr-7900000000-0d29222a67c465237ce2
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
15 7.32 73
26 3.67 37
27 1.34 13
29 2.05 21
38 3.79 38
39 6.3 63
41 15.38 154
50 4.71 47
51 7.37 74
52 10.02 100
53 6.91 69
54 6.59 66
55 1.14 11
61 1.11 11
62 3.13 31
63 11.5 115
64 10.51 105
65 7.16 72
66 1.32 13
67 1.87 19
69 1.43 14
74 1.36 14
77 5.8 58
79 3.36 34
80 6.7 67
82 1.55 16
92 6.05 61
95 35.4 354
96 2.09 21
107 1.67 17
108 1.76 18
123 99.99 999
124 7.99 80
138 82.02 820
139 7.57 76
//
system version 2.2.6-SNAPSHOT