MassBank Record: KO002384



 Dapsone; 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: KO002384
RECORD_TITLE: Dapsone; 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 A220

CH$NAME: 4-Aminophenylsulfone CH$NAME: 4,4'-Sulfonylbisbenzenamine CH$NAME: Dapsone CH$NAME: Diaphenylsulfone CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H12N2O2S CH$EXACT_MASS: 248.06195 CH$SMILES: Nc(c2)ccc(c2)S(=O)(=O)c(c1)ccc(N)c1 CH$IUPAC: InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2 CH$LINK: CAS 80-08-0 CH$LINK: KEGG C07666 CH$LINK: NIKKAJI J4.247A CH$LINK: PUBCHEM SID:9868
AC$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$FOCUSED_ION: PRECURSOR_M/Z 249 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a4i-1930000000-09cf0e392eeef139f2b1 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 43.600 29703.0 11 62.500 14851.5 6 80.800 9901.0 4 86.000 14851.5 6 92.200 529703.5 203 93.000 79208.0 30 101.600 19802.0 8 105.200 69307.0 27 108.200 608911.5 234 115.900 24752.5 9 123.100 29703.0 11 128.900 113861.5 44 133.800 29703.0 11 137.200 34653.5 13 138.100 69307.0 27 140.900 24752.5 9 142.700 19802.0 8 156.100 2603963.0 999 157.400 39604.0 15 157.700 14851.5 6 189.200 153465.5 59 232.500 89109.0 34 249.300 1391090.5 534 //