MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000848
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000848
RECORD_TITLE: DIMETHYLHYDRAZONE ACETONE; 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$NAME: DIMETHYLHYDRAZONE ACETONE
CH$NAME: ACETONE DIMETHYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H12N2
CH$EXACT_MASS: 100.10005
CH$SMILES: CC(C)=NN(C)C
CH$IUPAC: InChI=1S/C5H12N2/c1-5(2)6-7(3)4/h1-4H3
CH$LINK: INCHIKEY
IDSMDKUVIBSETN-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID40158998
AC$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: splash10-0006-9200000000-0ca50be469db3a27e06f
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
28 23.5 235
29 10.6 106
30 11.5 115
31 0.16 2
38 1.5 15
39 12.9 129
40 5.9 59
41 2.29 23
42 58.9 589
43 25.9 259
44 99.99 999
45 7.06 71
46 2.5 25
54 3.4 34
55 2.6 26
56 7.06 71
57 18.8 188
58 8.8 88
59 5.8 58
60 0.25 3
69 3.2 32
70 1.6 16
71 0.9 9
72 0.08 1
73 1.4 14
74 1.6 16
84 1.1 11
85 2.12 21
86 1.8 18
99 16.8 168
100 82.4 824
101 5.9 59
//
system version 2.2.6-SNAPSHOT