MassBank Record: JP000870



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

ACCESSION: JP000870
RECORD_TITLE: DIMETHYLHYDRAZONE BETA-METHYLACRYLALDEHYDE; 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$NAME: DIMETHYLHYDRAZONE BETA-METHYLACRYLALDEHYDE CH$NAME: 2-BUTENAL DIMETHYLHYDRAZONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12N2 CH$EXACT_MASS: 112.10005 CH$SMILES: CC=CC=NN(C)C CH$IUPAC: InChI=1S/C6H12N2/c1-4-5-6-7-8(2)3/h4-6H,1-3H3/b5-4+,7-6+
AC$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: splash10-0296-9100000000-1e311aa008df93b3b319 PK$NUM_PEAK: 42 PK$PEAK: m/z int. rel.int. 28 47.7 477 29 8.7 87 30 21.3 213 37 0.21 2 38 5.2 52 39 34.8 348 40 6.1 61 41 5.11 51 42 78.1 781 43 47.7 477 44 74 740 45 2.83 28 46 11.7 117 50 1.9 19 51 3.9 39 52 0.27 3 53 14.8 148 54 9.6 96 55 6.5 65 56 4.35 44 57 10 100 58 7.8 78 59 7.4 74 67 2.35 24 68 69.5 695 69 31.3 313 70 36.1 361 71 0.48 5 80 4.3 43 81 4.6 46 82 13 130 83 0.76 8 84 9.3 93 85 1.2 12 94 1.7 17 95 0.41 4 96 4.3 43 97 30 300 98 2 20 111 0.65 7 112 99.99 999 113 10 100 //