MassBank Record: KO002693



 Diazoxide; 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: KO002693
RECORD_TITLE: Diazoxide; 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 D051

CH$NAME: Diazoxide CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H7ClN2O2S CH$EXACT_MASS: 229.99168 CH$SMILES: CC(N1)=NS(=O)(=O)c(c2)c(ccc(Cl)2)1 CH$IUPAC: InChI=1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11) CH$LINK: CAS 364-98-7 CH$LINK: KEGG C06949 CH$LINK: NIKKAJI J5.703G CH$LINK: PUBCHEM SID:9164
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 231 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0bu3-1950000000-80f36d9e4aae5c2acf9c PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 57.300 24752.5 33 62.600 24752.5 33 72.700 29703.0 40 76.900 49505.0 66 90.800 54455.5 73 91.700 74257.5 99 100.300 143564.5 192 100.800 29703.0 40 112.300 19802.0 26 126.200 74257.5 99 138.300 14851.5 20 141.000 514852.0 688 141.900 54455.5 73 157.900 747525.5 999 170.200 19802.0 26 171.500 29703.0 40 190.100 103960.5 139 196.300 133663.5 179 214.400 653466.0 873 216.500 24752.5 33 231.100 440594.5 589 //