MassBank Record: JP000897



 3,5,5-TRIMETHYL-2-PYRAZOLINE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000897
RECORD_TITLE: 3,5,5-TRIMETHYL-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$NAME: 3,5,5-TRIMETHYL-2-PYRAZOLINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12N2 CH$EXACT_MASS: 112.10005 CH$SMILES: CC(=N1)CC(C)(C)N1 CH$IUPAC: InChI=1S/C6H12N2/c1-5-4-6(2,3)8-7-5/h8H,4H2,1-3H3
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$SPLASH: splash10-0002-9000000000-553364374fb26393499b PK$NUM_PEAK: 34 PK$PEAK: m/z int. rel.int. 26 1.5 15 27 8.2 82 28 15.7 157 29 0.62 6 30 5.1 51 38 0.9 9 39 10.3 103 40 0.22 2 41 11.5 115 42 14 140 43 3.1 31 44 0.04 0 51 1 10 52 0.6 6 53 2.4 24 54 0.31 3 55 3.1 31 56 41.9 419 57 3.5 35 58 0.06 1 67 1.4 14 68 0.7 7 69 0.5 5 70 0.4 4 80 0.6 6 81 1.1 11 83 1.9 19 95 0.17 2 96 1.3 13 97 99.99 999 98 6.2 62 111 0.05 1 112 23.5 235 113 2.4 24 //