MassBank Record: KO002649



 N,N-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: KO002649
RECORD_TITLE: N,N-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 D032

CH$NAME: N,N-Dimethylaniline CH$NAME: N,N-Dimethylbenzenamine CH$NAME: Dimethylaminobenzene CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H11N CH$EXACT_MASS: 121.08915 CH$SMILES: CN(C)c(c1)cccc1 CH$IUPAC: InChI=1S/C8H11N/c1-9(2)8-6-4-3-5-7-8/h3-7H,1-2H3 CH$LINK: CAS 121-69-7 CH$LINK: CHEBI 16269 CH$LINK: KEGG C02846 CH$LINK: NIKKAJI J2.488K CH$LINK: PUBCHEM SID:5785
AC$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$SPLASH: splash10-0a4i-0900000000-e2755a3a974bacd7cdf1 PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 45.000 59406.0 5 45.300 14851.5 1 54.900 9901.0 1 60.000 64356.5 6 77.100 188119.0 16 78.000 74257.5 6 78.800 108911.0 9 92.300 24752.5 2 93.100 34653.5 3 104.200 19802.0 2 105.500 158416.0 14 106.100 11643576.0 999 107.100 10955456.5 940 120.200 34653.5 3 122.200 252475.5 22 //