MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000886
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000886
RECORD_TITLE: DI-N-PROPYLHYDRAZONE BETA.BETA-DIMETHYLACRYLALDEHYDE; 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$NAME: DI-N-PROPYLHYDRAZONE BETA.BETA-DIMETHYLACRYLALDEHYDE
CH$NAME: 3-METHYL-2-BUTENAL DIPROPYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H22N2
CH$EXACT_MASS: 182.17830
CH$SMILES: CCCN(CCC)N=CC=C(C)C
CH$IUPAC: InChI=1S/C11H22N2/c1-5-9-13(10-6-2)12-8-7-11(3)4/h7-8H,5-6,9-10H2,1-4H3/b12-8+
CH$LINK: INCHIKEY
FTMKRAVFLAKCFZ-XYOKQWHBSA-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$SPLASH: splash10-0f89-9600000000-97bbcb14a6976615905b
PK$NUM_PEAK: 46
PK$PEAK: m/z int. rel.int.
28 12.4 124
29 14.6 146
30 26 260
39 1.39 14
40 4.4 44
41 34.7 347
42 19.6 196
43 4.13 41
44 5.4 54
51 1.2 12
53 10 100
54 0.33 3
55 30.4 304
56 9.6 96
57 2.4 24
58 0.72 7
65 2.6 26
67 13.9 139
68 6.1 61
69 4.13 41
70 13.2 132
71 1.5 15
72 26 260
73 0.22 2
80 5 50
81 4.6 46
82 30.4 304
83 0.74 7
84 6.3 63
87 2 20
94 4.9 49
95 0.24 2
96 3.6 36
97 8.1 81
98 2.4 24
100 0.33 3
109 2 20
110 3 30
111 54.2 542
112 0.63 6
124 5.4 54
125 3 30
153 99.99 999
154 1.24 12
182 56.4 564
183 10 100
//
system version 2.2.6-SNAPSHOT