MassBank Record: KO002352



 Amifostine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002352
RECORD_TITLE: Amifostine; LC-ESI-QQ; MS2; CE:50 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 A170

CH$NAME: Amifostine CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H15N2O3PS CH$EXACT_MASS: 214.05410 CH$SMILES: NCCCNCCSP(O)(O)=O CH$IUPAC: InChI=1S/C5H15N2O3PS/c6-2-1-3-7-4-5-12-11(8,9)10/h7H,1-6H2,(H2,8,9,10) CH$LINK: CAS 20537-88-6 CH$LINK: KEGG C06819 CH$LINK: NIKKAJI J23.675F
AC$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 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 215 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a4l-9000000000-c58215f6bca055f13ab7 PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 43.100 99010.0 285 44.000 64356.5 186 55.200 346535.0 999 57.300 49505.0 143 57.500 14851.5 43 66.900 59406.0 171 69.300 123762.5 357 69.500 24752.5 71 70.100 14851.5 43 78.100 14851.5 43 80.200 34653.5 100 83.300 49505.0 143 92.400 19802.0 57 93.100 39604.0 114 96.200 39604.0 114 //