MassBank Record: JP000409



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

ACCESSION: JP000409
RECORD_TITLE: 1-BUTYL-5-METHYL-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$NAME: 1-BUTYL-5-METHYL-2-PYRAZOLINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H16N2 CH$EXACT_MASS: 140.13135 CH$SMILES: CCCCN(N=1)C(C)CC([H])1 CH$IUPAC: InChI=1S/C8H16N2/c1-3-4-7-10-8(2)5-6-9-10/h6,8H,3-5,7H2,1-2H3
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$SPLASH: splash10-0002-9000000000-fddac03ffc5b4a4a2111 PK$NUM_PEAK: 33 PK$PEAK: m/z int. rel.int. 26 0.5 5 27 5.5 55 29 6.7 67 30 0.45 5 39 3.3 33 40 0.7 7 41 8.6 86 42 0.61 6 43 1.7 17 44 0.8 8 52 0.2 2 53 0.08 1 54 1.6 16 55 7.3 73 56 3.1 31 57 0.25 3 68 2.5 25 69 24.5 245 70 2.1 21 80 0.05 1 81 0.5 5 82 0.5 5 83 1.5 15 84 0.06 1 95 0.4 4 97 99.99 999 98 5 50 111 0.03 0 125 4.6 46 126 0.4 4 139 0.5 5 140 1.05 11 141 1 10 //