MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000523
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000523
RECORD_TITLE: METHYLHYDRAZONE 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$NAME: METHYLHYDRAZONE ISOBUTYRALDEHYDE
CH$NAME: ISOBUTYRALDEHYDE METHYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H12N2
CH$EXACT_MASS: 100.10005
CH$SMILES: CNN=CC(C)C
CH$IUPAC: InChI=1S/C5H12N2/c1-5(2)4-7-6-3/h4-6H,1-3H3/b7-4+
CH$LINK: INCHIKEY
QLVOGAHIAVPTFB-QPJJXVBHSA-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$SPLASH: splash10-0kcu-9100000000-f557624018f4431477e9
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
26 4 40
27 25 250
28 61.6 616
29 3.76 38
30 97.7 977
31 10.8 108
32 32.9 329
37 0.13 1
38 2.7 27
39 23.5 235
40 4.2 42
41 5.35 54
42 40.9 409
43 36.5 365
44 32.6 326
45 1.48 15
51 1.4 14
52 2 20
53 2.4 24
54 0.8 8
55 6.4 64
56 29.9 299
57 69.6 696
58 2.03 20
59 1.7 17
68 5.7 57
69 5.6 56
70 1.29 13
71 12.4 124
72 9.9 99
83 1.1 11
85 7.47 75
86 4.2 42
99 3 30
100 99.99 999
101 12.3 123
//