MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009421
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009421
RECORD_TITLE: ORTHO-ETHOXYBENZAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: ORTHO-ETHOXYBENZAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11NO2
CH$EXACT_MASS: 165.07898
CH$SMILES: CCOc(c1)c(ccc1)C(N)=O
CH$IUPAC: InChI=1S/C9H11NO2/c1-2-12-8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3,(H2,10,11)
CH$LINK: COMPTOX
DTXSID4020581
CH$LINK: INCHIKEY
SBNKFTQSBPKMBZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:3282
AC$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: splash10-00dl-6900000000-8e77edbc0a9e88098d92
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
26 3.64 36
27 18.24 182
28 16.74 167
29 16.12 161
32 5.92 59
38 2.5 25
39 7.89 79
43 1.66 17
44 7.59 76
50 3.51 35
51 3.94 39
52 1.73 17
53 2.87 29
61 1.03 10
62 2.79 28
63 10.4 104
64 10.56 106
65 18.6 186
66 2.72 27
74 2.1 21
75 1.95 20
76 4.33 43
77 6.36 64
78 1.74 17
79 1.28 13
80 10.21 102
81 1.37 14
91 7.37 74
92 73.24 732
93 14.29 143
94 1.91 19
102 1.36 14
104 2.17 22
105 48.19 482
106 4.22 42
108 3.57 36
119 3.72 37
120 99.99 999
121 36.95 370
122 5.98 60
131 1.38 14
133 27.54 275
134 2.7 27
137 1.94 19
146 1.24 12
147 1.83 18
148 38.68 387
149 7.14 71
150 39.73 397
151 3.74 37
165 8.24 82
166 3.27 33
//