MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000521
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000521
RECORD_TITLE: ISOPROPYLHYDRAZONE 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$NAME: ISOPROPYLHYDRAZONE ACETALDEHYDE
CH$NAME: ACETALDEHYDE ISOPROPYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H12N2
CH$EXACT_MASS: 100.10005
CH$SMILES: CC=NNC(C)C
CH$IUPAC: InChI=1S/C5H12N2/c1-4-6-7-5(2)3/h4-5,7H,1-3H3/b6-4+
CH$LINK: INCHIKEY
CHDZJJJPEGMSAM-GQCTYLIASA-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$SPLASH: splash10-000f-9100000000-3b9f57646c4fc4cf7e49
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
28 22.8 228
29 8.6 86
30 11.9 119
31 0.37 4
39 6.1 61
40 3 30
41 19.3 193
42 2.81 28
43 22.8 228
44 73.8 738
45 3 30
55 0.14 1
56 4.2 42
57 10.5 105
58 12.4 124
59 0.16 2
68 1 10
69 1.1 11
85 99.99 999
86 0.61 6
99 2.1 21
100 38.5 385
101 4.7 47
//