MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011885
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011885
RECORD_TITLE: 4-NITROPHENYLHYDRAZINE; 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$NAME: 4-NITROPHENYLHYDRAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H7N3O2
CH$EXACT_MASS: 153.05383
CH$SMILES: NNc(c1)ccc(c1)[N+1]([O-1])=O
CH$IUPAC: InChI=1S/C6H7N3O2/c7-8-5-1-3-6(4-2-5)9(10)11/h1-4,8H,7H2
CH$LINK: CAS
100-16-3
CH$LINK: NIKKAJI
J59.887I
CH$LINK: INCHIKEY
KMVPXBDOWDXXEN-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4059207
AC$INSTRUMENT: HITACHI M-2500
AC$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$SPLASH: splash10-0udi-9500000000-c35caa4cc0f2fbabad94
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
17 2.03 20
18 7.85 79
26 1.09 11
27 2.16 22
28 5.12 51
29 3.09 31
30 7.59 76
31 1.94 19
37 2.66 27
38 5.89 59
39 11.28 113
40 1.67 17
41 3.96 40
42 1.06 11
43 1.23 12
46 1.51 15
50 14.58 146
51 12.73 127
52 10.33 103
53 9.88 99
54 2.56 26
56 1.11 11
61 2.66 27
62 6.05 61
63 26.89 269
64 16.01 160
65 13.06 131
66 2.3 23
67 1.79 18
73 1.25 13
74 7.04 70
75 7.36 74
76 9.63 96
77 9.6 96
78 5.88 59
79 4.1 41
80 22.78 228
81 3.59 36
90 32.24 322
91 13.38 134
92 4.97 50
93 2.85 29
105 2.94 29
106 5.35 54
107 14.25 143
108 3.92 39
109 4.51 45
122 5.05 51
123 31.92 319
124 2.41 24
137 1.98 20
138 3.74 37
139 5.82 58
150 4.33 43
151 7 70
152 1.19 12
153 99.99 999
154 8 80
//