MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000860
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000860
RECORD_TITLE: ALLYLHYDRAZONE 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$NAME: ALLYLHYDRAZONE ACETONE
CH$NAME: ACETONE ALLYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H12N2
CH$EXACT_MASS: 112.10005
CH$SMILES: C=CCNN=C(C)C
CH$IUPAC: InChI=1S/C6H12N2/c1-4-5-7-8-6(2)3/h4,7H,1,5H2,2-3H3
CH$LINK: INCHIKEY
ODEDRFAFCSZTSO-UHFFFAOYSA-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$SPLASH: splash10-0bvr-9100000000-3d83fb711f76eeabbc89
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
27 22.7 227
28 60 600
29 20 200
30 5.34 53
31 5.3 53
39 36 360
40 8.7 87
41 5.07 51
42 46 460
43 12 120
44 8.7 87
54 1.14 11
55 13.4 134
56 99.99 999
57 1.14 11
58 6 60
68 6.7 67
69 8 80
70 13.4 134
71 8.67 87
72 6.7 67
80 1.7 17
81 1.5 15
82 0.19 2
83 37.4 374
84 6.7 67
85 30.7 307
96 0.25 3
97 13.4 134
111 10.7 107
112 80 800
113 9.3 93
//