MassBank Record: KO000591



 2,6-Dichloro-4-nitroaniline; 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: KO000591
RECORD_TITLE: 2,6-Dichloro-4-nitroaniline; 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 D048

CH$NAME: 2,6-Dichloro-4-nitroaniline CH$NAME: DCNA CH$NAME: Dichloran CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H4Cl2N2O2 CH$EXACT_MASS: 205.96498 CH$SMILES: [O-1][N+1](=O)c(c1)cc(Cl)c(N)c(Cl)1 CH$IUPAC: InChI=1S/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2 CH$LINK: CAS 99-30-9 CH$LINK: KEGG C11000 CH$LINK: NIKKAJI J5.236A CH$LINK: PUBCHEM SID:13183
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 205 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0a4i-0290000000-2f0862233376712738da PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 34.900 188119.0 6 46.100 207921.0 7 59.200 559406.5 19 59.900 74257.5 2 62.300 24752.5 1 72.600 24752.5 1 74.100 34653.5 1 88.100 24752.5 1 95.000 163366.5 5 103.200 217822.0 7 122.800 742575.0 25 132.700 69307.0 2 133.400 24752.5 1 138.900 1089110.0 36 141.100 44554.5 1 149.000 396040.0 13 158.800 341584.5 11 162.600 14851.5 1 169.000 1009902.0 34 172.300 74257.5 2 175.200 1985150.5 66 177.000 74257.5 2 189.300 648515.5 22 190.200 99010.0 3 203.000 14851.5 1 205.400 30079238.0 999 //