ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009954
RECORD_TITLE: 3,4-DIHYDRO-6-HYDROXY-2-(2-(IMIDAZOL-1-YL)ETHYL)-2,5,7,8-TETRAMETHYL-2H-1-BENZOPYRAN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 3,4-DIHYDRO-6-HYDROXY-2-(2-(IMIDAZOL-1-YL)ETHYL)-2,5,7,8-TETRAMETHYL-2H-1-BENZOPYRAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H24N2O2
CH$EXACT_MASS: 300.18378
CH$SMILES: c(n3)cn(c3)CCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1
CH$IUPAC: InChI=1S/C18H24N2O2/c1-12-13(2)17-15(14(3)16(12)21)5-6-18(4,22-17)7-9-20-10-8-19-11-20/h8,10-11,21H,5-7,9H2,1-4H3
CH$LINK: INCHIKEY YRQDSILNLFORDF-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-300
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-4900000000-7c8243d5e51b47bd0cad
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  28 8.6 86
  32 4.1 41
  41 5 50
  43 0.45 5
  44 3.8 38
  69 21.7 217
  73 4.1 41
  77 0.48 5
  81 6.3 63
  82 16.7 167
  105 5.9 59
  121 0.47 5
  122 5.3 53
  135 4.7 47
  136 3.8 38
  137 99.99 999
  138 9.7 97
  164 5.8 58
  203 9.1 91
  300 3.28 33
  301 6.3 63
//
