MassBank Record: MSBNK-RIKEN-PR010185
ACCESSION: MSBNK-RIKEN-PR010185
RECORD_TITLE: Phenylhydrazine; GC-EI-TOF; MS; 1 TMS; BP:73
DATE: 2016.01.19 (Created 2006.12.21, modified 2011.05.06)
AUTHORS: Kusano M, Fukushima A, Plant Science Center, RIKEN.
LICENSE: CC BY-SA
CH$NAME: Phenylhydrazine
CH$NAME: Phenyldiazane
CH$NAME: Hydrazinobenzene
CH$COMPOUND_CLASS: Natural Product
CH$FORMULA: C6H8N2
CH$EXACT_MASS: 108.06875
CH$SMILES: NNc(c1)cccc1
CH$IUPAC: InChI=1S/C6H8N2/c7-8-6-4-2-1-3-5-6/h1-5,8H,7H2
CH$LINK: CAS
100-63-0
CH$LINK: KEGG
C02304
CH$LINK: NIKKAJI
J38.250G
CH$LINK: PUBCHEM 5358
CH$LINK: INCHIKEY
HKOOXMFOFWEVGF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8021147
AC$INSTRUMENT: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
AC$INSTRUMENT_TYPE: GC-EI-TOF
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$CHROMATOGRAPHY: RETENTION_INDEX 1315.7
AC$CHROMATOGRAPHY: RETENTION_TIME 353.422 sec
MS$FOCUSED_ION: BASE_PEAK 73
MS$FOCUSED_ION: DERIVATIVE_FORM C9H16N2Si
MS$FOCUSED_ION: DERIVATIVE_MASS 180.10828
MS$FOCUSED_ION: DERIVATIVE_TYPE 1 TMS
MS$DATA_PROCESSING: WHOLE ChromaTOF ver. 2.32 (Leco)
PK$SPLASH: splash10-00di-9100000000-4a080ef5f39368c6e8ab
PK$NUM_PEAK: 70
PK$PEAK: m/z int. rel.int.
60 3 3
61 5 5
62 2 2
63 11 11
64 10 10
65 10 10
66 3 3
67 3 3
70 4 4
71 4 4
72 10 10
73 999 999
74 88 88
75 39 39
76 4 4
77 12 12
78 3 3
79 3 3
80 3 3
81 1 1
83 4 4
84 1 1
85 2 2
87 2 2
89 5 5
90 1 1
91 16 16
92 10 10
93 3 3
95 1 1
102 1 1
103 5 5
104 1 1
105 8 8
106 1 1
107 3 3
108 4 4
109 1 1
115 3 3
117 1 1
119 2 2
121 1 1
131 5 5
133 5 5
135 4 4
136 44 44
137 8 8
138 2 2
147 5 5
148 1 1
149 5 5
150 1 1
151 55 55
152 7 7
153 2 2
161 1 1
163 1 1
165 1 1
166 31 31
167 5 5
168 1 1
179 2 2
181 1 1
182 1 1
239 25 25
240 7 7
241 2 2
254 44 44
255 11 11
256 4 4
//
system version 2.2.8-SNAPSHOT