MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003032
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003032
RECORD_TITLE: TRANS-AZOBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: TRANS-AZOBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10N2
CH$EXACT_MASS: 182.08440
CH$SMILES: c(c2)ccc(c2)N=Nc(c1)cccc1
CH$IUPAC: InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+
CH$LINK: INCHIKEY
DMLAVOWQYNRWNQ-BUHFOSPRSA-N
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-004i-9200000000-973c11e0b7df89ac49d6
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
26 0.3 3
27 2.7 27
37 0.5 5
38 0.15 2
39 2.5 25
40 0.3 3
41 0.3 3
49 0.01 0
50 2 20
51 20.8 208
52 0.8 8
61 0.02 0
62 0.4 4
63 1.8 18
64 2.1 21
65 0.08 1
74 0.6 6
75 0.6 6
76 0.4 4
77 99.99 999
78 6.3 63
89 0.2 2
90 0.2 2
91 0.05 1
93 0.3 3
102 0.4 4
105 1.8 18
106 0.14 1
115 1 10
127 0.4 4
128 0.8 8
139 0.04 0
151 1.2 12
152 4.8 48
153 4.1 41
154 0.09 1
182 27.3 273
183 3.4 34
//
system version 2.2.8-SNAPSHOT