MassBank Record: KO000589



 2,6-Dichloro-4-nitroaniline; LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000589
RECORD_TITLE: 2,6-Dichloro-4-nitroaniline; LC-ESI-QQ; MS2; CE:10 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$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 205 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0a4i-0090000000-60c37dd3b5ac0243e1c6 PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 59.000 400990.5 3 59.700 69307.0 1 93.100 49505.0 1 122.800 34653.5 1 143.400 29703.0 1 146.700 54455.5 1 160.700 44554.5 1 169.200 628713.5 5 171.800 84158.5 1 172.200 475248.0 4 172.800 19802.0 1 174.900 29703.0 1 205.200 135465482.0 999 //