MassBank Record: JP000420



 1-ETHYL-3-ISOPROPYL-5,5-DIMETHYL-3,4-DIHYDROFORMAZAN; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000420
RECORD_TITLE: 1-ETHYL-3-ISOPROPYL-5,5-DIMETHYL-3,4-DIHYDROFORMAZAN; 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$NAME: 1-ETHYL-3-ISOPROPYL-5,5-DIMETHYL-3,4-DIHYDROFORMAZAN CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H20N4 CH$EXACT_MASS: 172.16880 CH$SMILES: CCN=NC(NN(C)C)C(C)C CH$IUPAC: InChI=1S/C8H20N4/c1-6-9-10-8(7(2)3)11-12(4)5/h7-8,11H,6H2,1-5H3/b10-9+
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$SPLASH: splash10-0aou-9200000000-3795e1f6d34a3bd9c895 PK$NUM_PEAK: 32 PK$PEAK: m/z int. rel.int. 27 11.2 112 28 18 180 29 13.5 135 30 1.01 10 39 3.7 37 40 1.1 11 41 9.1 91 42 1.46 15 43 21.3 213 44 36 360 45 10.1 101 46 1.12 11 54 0.9 9 55 9.2 92 56 5.4 54 57 0.34 3 58 5.4 54 59 99.99 999 60 5.4 54 68 0.07 1 70 4.4 44 71 2.1 21 72 7.9 79 73 0.55 6 85 1.8 18 86 0.8 8 99 3.3 33 100 0.16 2 113 0.9 9 114 2.7 27 115 56.1 561 116 4.7 47 //