MassBank Record: KO002648



 N,N-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: KO002648
RECORD_TITLE: N,N-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 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 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 122 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a4i-0900000000-1402f1580a4bb8ce5135 PK$NUM_PEAK: 16 PK$PEAK: m/z int. rel.int. 40.700 9901.0 1 44.700 39604.0 2 50.100 39604.0 2 55.300 54455.5 3 60.900 29703.0 2 69.200 247525.0 14 78.200 29703.0 2 86.800 99010.0 6 93.100 64356.5 4 93.600 49505.0 3 103.700 79208.0 4 105.000 64356.5 4 105.900 1346536.0 76 107.000 17757443.5 999 120.100 34653.5 2 122.200 7049512.0 397 //