MassBank Record: KO002808



 2,4-Dimethylaniline; LC-ESI-QQ; MS2; CE:30 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002808
RECORD_TITLE: 2,4-Dimethylaniline; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID D180

CH$NAME: 2,4-Dimethylaniline CH$NAME: 2,4-DMA CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H11N CH$EXACT_MASS: 121.08915 CH$SMILES: Cc(c1)cc(C)c(N)c1 CH$IUPAC: InChI=1S/C8H11N/c1-6-3-4-8(9)7(2)5-6/h3-5H,9H2,1-2H3 CH$LINK: CAS 95-68-1 CH$LINK: KEGG C11003 CH$LINK: NIKKAJI J358A CH$LINK: PUBCHEM SID:13186
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 122 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a6r-5900000000-1fae6186f90e67df0806 PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 40.800 49505.0 4 45.000 143564.5 12 46.100 54455.5 5 51.100 39604.0 3 65.000 133663.5 11 65.900 34653.5 3 69.400 64356.5 5 72.400 14851.5 1 77.100 8465355.0 702 79.000 8955454.5 743 79.800 69307.0 6 84.400 39604.0 3 88.900 29703.0 2 89.800 29703.0 2 91.300 29703.0 2 93.200 123762.5 10 94.600 84158.5 7 95.000 732674.0 61 102.100 59406.0 5 102.900 5158421.0 428 104.300 94059.5 8 105.000 6415848.0 532 106.000 5386144.0 447 107.100 12044566.5 999 119.000 14851.5 1 120.000 118812.0 10 122.200 846535.5 70 //