MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000831
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000831
RECORD_TITLE: DIMETHYLHYDRAZONE ISOBUTYRALDEHYDE; 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$NAME: DIMETHYLHYDRAZONE ISOBUTYRALDEHYDE
CH$NAME: ISOBUTYRALDEHYDE DIMETHYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14N2
CH$EXACT_MASS: 114.11570
CH$SMILES: CC(C)C=NN(C)C
CH$IUPAC: InChI=1S/C6H14N2/c1-6(2)5-7-8(3)4/h5-6H,1-4H3/b7-5+
CH$LINK: INCHIKEY
WQDBBOLZIXTESN-FNORWQNLSA-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$SPLASH: splash10-0006-9100000000-1ddf632d048c5ce78ebd
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
27 13.3 133
28 22.9 229
29 7.6 76
30 0.53 5
39 9.7 97
40 2.7 27
41 15.7 157
42 3.37 34
43 99.99 999
44 95.2 952
45 37 370
46 0.78 8
52 0.8 8
53 1.4 14
54 1.9 19
55 0.35 4
56 15.7 157
57 2.7 27
58 28.9 289
59 0.55 6
68 1.7 17
69 1.5 15
70 6.4 64
71 0.68 7
72 9.4 94
73 0.6 6
83 1.9 19
85 0.46 5
86 1.6 16
97 0.8 8
99 42.2 422
100 0.33 3
113 2.1 21
114 49.5 495
115 5.8 58
//
system version 2.2.6-SNAPSHOT