MassBank Record: JP000733



 6-ACETAMINOFLAVANONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000733
RECORD_TITLE: 6-ACETAMINOFLAVANONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKATORI M, DEPT. OF CHEMISTRY, FAC. OF EDUC., FUKUSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 6-ACETAMINOFLAVANONE CH$NAME: 6-ACETAMIDO-2-PHENYLCHROMAN-4-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H15NO3 CH$EXACT_MASS: 281.10519 CH$SMILES: CC(=O)Nc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cccc1 CH$IUPAC: InChI=1S/C17H15NO3/c1-11(19)18-13-7-8-16-14(9-13)15(20)10-17(21-16)12-5-3-2-4-6-12/h2-9,17H,10H2,1H3,(H,18,19)
AC$INSTRUMENT: JEOL JMS-06-H AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-005i-4930000000-23c4a577433e859f7505 PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 27 2.5 25 28 12.2 122 29 2.3 23 31 0.26 3 39 2.7 27 41 2.1 21 43 35.3 353 45 0.32 3 51 7.9 79 52 8.8 88 53 4.9 49 77 1.18 12 78 9.1 91 79 22.8 228 80 6.5 65 91 0.25 3 103 10.9 109 104 8.8 88 105 2.4 24 106 0.53 5 107 17 170 108 2.5 25 131 3 30 134 1.4 14 135 99.99 999 136 9.9 99 149 5.7 57 162 0.31 3 177 72.8 728 178 9.3 93 204 8.6 86 238 0.33 3 239 5 50 280 6.8 68 281 81.6 816 282 1.44 14 283 2.7 27 //