MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004094
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004094
RECORD_TITLE: N-HYDROXY-4-PYRIDONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: N-HYDROXY-4-PYRIDONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H5NO2
CH$EXACT_MASS: 111.03203
CH$SMILES: O=C(C=1)C=CN(O)C1
CH$IUPAC: InChI=1S/C5H5NO2/c7-5-1-3-6(8)4-2-5/h1-4,8H
CH$LINK: INCHIKEY
NCDOCXYTOYFYHI-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6E
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: splash10-03fv-9200000000-94b387266ffbbdb5daaa
PK$NUM_PEAK: 56
PK$PEAK: m/z int. rel.int.
18 12 120
20 2.3 23
25 3.1 31
26 23.3 233
27 26.5 265
28 22.1 221
29 11.4 114
30 2.04 20
31 2.1 21
37 7.1 71
38 15.1 151
39 4.75 48
40 22.7 227
41 42.9 429
42 13.1 131
44 0.67 7
45 4.9 49
47.5 1.5 15
49 3 30
50 1.01 10
51 12.7 127
52 8 80
53 17.9 179
54 1.59 16
55 34 340
55.5 5.9 59
56 9 90
57 6.33 63
58 5.1 51
62 1.7 17
63 2.2 22
64 0.27 3
65 2.8 28
66 8.9 89
67 19.5 195
68 2.87 29
69 10 100
70 2.6 26
71 9.2 92
75 0.17 2
76 3.2 32
77 1.6 16
78 1.5 15
81 0.13 1
82 2.5 25
83 5.2 52
84 7.1 71
85 0.14 1
91 1.5 15
94 7.9 79
95 89 890
96 0.63 6
110 22.8 228
111 99.99 999
112 7 70
113 1 10
//