MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000892
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000892
RECORD_TITLE: 5,5-DIMETHYL-2-PYRAZOLINE; 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$NAME: 5,5-DIMETHYL-2-PYRAZOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10N2
CH$EXACT_MASS: 98.08440
CH$SMILES: CC(C)(C1)NN=C1
CH$IUPAC: InChI=1S/C5H10N2/c1-5(2)3-4-6-7-5/h4,7H,3H2,1-2H3
CH$LINK: INCHIKEY
FLYZAKYDSFYRRD-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID10339676
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$SPLASH: splash10-001l-9000000000-ee3a443e49a2b7cc05b3
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
26 1.9 19
27 10 100
28 24.4 244
29 0.65 7
30 3.6 36
38 1.5 15
39 11 110
40 0.32 3
41 16.6 166
42 50 500
43 7.5 75
50 0.09 1
51 1.3 13
52 0.8 8
53 2.6 26
54 0.26 3
55 1.9 19
56 23.4 234
57 2.4 24
58 0.07 1
66 0.9 9
67 1 10
68 1.2 12
81 0.19 2
82 0.5 5
83 99.99 999
84 5.2 52
97 0.06 1
98 30.1 301
99 2.6 26
//