MassBank Record: KO002807



 2,4-Dimethylaniline; LC-ESI-QQ; MS2; CE:20 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002807
RECORD_TITLE: 2,4-Dimethylaniline; LC-ESI-QQ; MS2; CE:20 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 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 122 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0ab9-0900000000-c13b3fa3006ee1b9099b PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 43.700 24752.5 1 44.800 99010.0 4 45.700 188119.0 8 50.300 64356.5 3 55.400 79208.0 3 59.100 99010.0 4 61.400 24752.5 1 63.200 39604.0 2 69.100 292079.5 12 73.300 69307.0 3 76.100 24752.5 1 77.100 529703.5 22 79.100 1886140.5 77 79.700 54455.5 2 87.300 599010.5 25 90.400 94059.5 4 92.800 39604.0 2 94.900 123762.5 5 98.200 34653.5 1 102.900 1361387.5 56 105.000 11123773.5 456 105.600 504951.0 21 107.100 24396064.0 999 120.200 297030.0 12 121.500 163366.5 7 122.200 23975271.5 982 123.100 262376.5 11 //