MassBank Record: JP004548



 DIBUTYL 1-(N-TRIFLUOROACETYLAMINO)PENTYLPHOSPHONATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP004548
RECORD_TITLE: DIBUTYL 1-(N-TRIFLUOROACETYLAMINO)PENTYLPHOSPHONATE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: HAYASHI ADEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV., DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: DIBUTYL 1-(N-TRIFLUOROACETYLAMINO)PENTYLPHOSPHONATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H29F3NO4P CH$EXACT_MASS: 375.17863 CH$SMILES: CCCCOP(=O)(OCCCC)C(CCCC)NC(=O)C(F)(F)F CH$IUPAC: InChI=1S/C15H29F3NO4P/c1-4-7-10-13(19-14(20)15(16,17)18)24(21,22-11-8-5-2)23-12-9-6-3/h13H,4-12H2,1-3H3,(H,19,20) CH$LINK: INCHIKEY VTGKYJIQDAIQCK-UHFFFAOYSA-N
AC$INSTRUMENT: SHIMADZU LKB-9000B AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000i-2920000000-efe07716c894253510b8 PK$NUM_PEAK: 50 PK$PEAK: m/z int. rel.int. 69 5.1 51 82 2.9 29 83 43.7 437 96 0.14 1 97 1 10 99 4 40 109 2.8 28 110 0.4 4 111 1.2 12 112 1 10 114 3.6 36 123 1.75 18 124 1.1 11 126 9.5 95 136 1.9 19 137 0.29 3 138 45.6 456 139 99.99 999 140 7.7 77 141 0.1 1 145 2 20 150 1.6 16 152 3.3 33 155 0.36 4 164 1.4 14 165 2.1 21 166 2.8 28 178 0.12 1 179 3.3 33 180 3 30 182 20.5 205 183 0.23 2 189 1.4 14 194 12.1 121 195 2.9 29 206 0.34 3 207 11.2 112 208 10 100 211 3.1 31 220 0.42 4 246 8.1 81 263 3.1 31 264 18.2 182 265 0.15 2 302 2 20 319 3.8 38 320 4.6 46 332 0.1 1 375 0.9 9 376 1.8 18 //