MassBank Record: JP000871



 DIMETHYLHYDRAZONE TIGLYLALDEHYDE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000871
RECORD_TITLE: DIMETHYLHYDRAZONE TIGLYLALDEHYDE; 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$NAME: DIMETHYLHYDRAZONE TIGLYLALDEHYDE CH$NAME: 2-METHYL-2-BUTENAL DIMETHYLHYDRAZONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H14N2 CH$EXACT_MASS: 126.11570 CH$SMILES: CC=C(C)C=NN(C)C CH$IUPAC: InChI=1S/C7H14N2/c1-5-7(2)6-8-9(3)4/h5-6H,1-4H3/b7-5-,8-6+
AC$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: splash10-002f-9100000000-ba0e6e30518b3ff9ee91 PK$NUM_PEAK: 54 PK$PEAK: m/z int. rel.int. 26 1.3 13 28 32.5 325 29 27 270 30 2.98 30 31 1.1 11 37 1.1 11 38 0.3 3 39 2.7 27 40 6.5 65 41 29.8 298 42 76 760 43 5.15 52 44 99.99 999 45 30 300 46 17.6 176 49 0.1 1 50 2.4 24 51 3.5 35 52 3.8 38 53 2.22 22 54 11.6 116 55 40.6 406 56 21.4 214 57 0.57 6 58 11.1 111 59 8.1 81 63 6.2 62 65 0.46 5 66 2.2 22 67 27 270 68 9 90 69 0.32 3 70 21.4 214 71 5.4 54 72 4.6 46 80 0.13 1 81 25.7 257 82 93 930 83 22.7 227 84 1.08 11 85 1.1 11 94 4.6 46 95 6.8 68 96 1.02 10 97 4.6 46 98 3.5 35 108 0.7 7 109 0.32 3 110 24.3 243 111 46 460 112 3.8 38 125 0.3 3 126 67.6 676 127 6.6 66 //