ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000704
RECORD_TITLE: 3-BENZOYLAMINOCHROMONE; 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$NAME: 3-BENZOYLAMINOCHROMONE
CH$NAME: 3-BENZAMIDO-4H-CHROMEN-4-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H11NO3
CH$EXACT_MASS: 265.07389
CH$SMILES: c(c3)ccc(c3)C(=O)NC(=C1)C(=O)c(c2)c(ccc2)O1
CH$IUPAC: InChI=1S/C16H11NO3/c18-15-12-8-4-5-9-14(12)20-10-13(15)17-16(19)11-6-2-1-3-7-11/h1-10H,(H,17,19)
CH$LINK: INCHIKEY OKPNWMHDUXGYHN-UHFFFAOYSA-N
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$SPLASH: splash10-0a6r-7940000000-18b29b8307254891d96a
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  28 4.5 45
  50 5.1 51
  51 14.2 142
  76 0.5 5
  77 64.8 648
  78 4.3 43
  105 99.99 999
  106 0.99 10
  133 2.1 21
  149 3.8 38
  265 45.1 451
  266 7.2 72
//
