MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005618
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005618
RECORD_TITLE: 5-FLUOROURIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 5-FLUOROURIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11FN2O6
CH$EXACT_MASS: 262.06011
CH$SMILES: OCC(O1)C(O)C(O)C1N(C=2)C(=O)NC(=O)C(F)2
CH$IUPAC: InChI=1S/C9H11FN2O6/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)
CH$LINK: INCHIKEY
FHIDNBAQOFJWCA-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 24 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-9600000000-fd6782fb2c85fd989568
PK$NUM_PEAK: 71
PK$PEAK: m/z int. rel.int.
39 7 70
40 4 40
41 14 140
42 0.08 1
43 21 210
44 17 170
45 23 230
55 0.17 2
56 10 100
57 42 420
58 13 130
59 0.11 1
60 23 230
61 21 210
68 6 60
69 0.17 2
70 8 80
71 27 270
72 10 100
73 0.52 5
74 12 120
75 6 60
77 2 20
82 0.01 0
83 2 20
84 7 70
85 21 210
86 0.11 1
87 25 250
88 13 130
89 3 30
97 0.13 1
98 2 20
100 9 90
101 10 100
102 0.07 1
103 10 100
112 2 20
113 8 80
114 0.17 2
115 25 250
116 7 70
128 5 50
130 0.32 3
131 35 350
132 10 100
133 99.99 999
134 0.13 1
135 3 30
142 2 20
143 4 40
156 0.02 0
157 2 20
158 1 10
159 4 40
171 0.04 0
172 1 10
173 10 100
174 1 10
185 0.03 0
187 2 20
189 3 30
197 3 30
201 0.02 0
213 8 80
214 1 10
228 1 10
231 0.01 0
244 3 30
262 13 130
263 4 40
//