MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000416
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000416
RECORD_TITLE: TETRAISOPROPYL-2-TETRAZENE; 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$NAME: TETRAISOPROPYL-2-TETRAZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H28N4
CH$EXACT_MASS: 228.23140
CH$SMILES: CC(C)N(C(C)C)N=NN(C(C)C)C(C)C
CH$IUPAC: InChI=1S/C12H28N4/c1-9(2)15(10(3)4)13-14-16(11(5)6)12(7)8/h9-12H,1-8H3/b14-13+
CH$LINK: INCHIKEY
ZNDMWJNPHFHXFT-BUHFOSPRSA-N
AC$INSTRUMENT: SHIMADZU LKB-2091
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: splash10-052f-9010000000-a4c18ed46200345da8ac
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
27 10.7 107
29 1.1 11
30 3.2 32
31 0.52 5
39 2.6 26
40 0.7 7
41 17.8 178
42 2.64 26
43 72.9 729
44 21.4 214
45 0.5 5
54 0.03 0
55 0.3 3
56 10.7 107
57 1.1 11
58 99.99 999
59 3.6 36
60 0.2 2
68 0.3 3
69 0.02 0
70 3.6 36
71 0.8 8
72 0.2 2
73 3.07 31
74 1.1 11
84 4.2 42
85 0.7 7
86 0.56 6
87 0.3 3
98 0.4 4
99 1 10
100 0.23 2
101 0.8 8
115 4.2 42
116 0.3 3
128 0.05 1
155 0.1 1
228 30.7 307
229 3.6 36
230 0.2 2
//