MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000834
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000834
RECORD_TITLE: ETHYLISOPROPYLHYDRAZONE ACETALDEHYDE; 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$NAME: ETHYLISOPROPYLHYDRAZONE ACETALDEHYDE
CH$NAME: ACETALDEHYDE ETHYLISOPROPYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H16N2
CH$EXACT_MASS: 128.13135
CH$SMILES: CC=NN(CC)C(C)C
CH$IUPAC: InChI=1S/C7H16N2/c1-5-8-9(6-2)7(3)4/h5,7H,6H2,1-4H3/b8-5+
CH$LINK: INCHIKEY
KBQAGUKZIMHXKW-VMPITWQZSA-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$SPLASH: splash10-03fu-9400000000-867c772cc2a47ff3416c
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
27 15.8 158
28 15.8 158
29 28.5 285
30 1.16 12
39 4.9 49
40 1.8 18
41 13.3 133
42 4.25 43
43 17 170
44 27.9 279
45 1.1 11
54 0.11 1
55 1.9 19
56 14.6 146
57 6.9 69
58 0.38 4
68 1.7 17
69 2.1 21
70 19.4 194
71 4.49 45
72 4.8 48
84 15.8 158
85 12.1 121
86 0.12 1
113 99.99 999
114 8.4 84
127 1 10
128 3.27 33
129 4.1 41
//