ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010149
RECORD_TITLE: 2-CYANOETHYL-6-HYDROXY-2,5,7,8-TETRAMETHYL-3,4-DIHYDRO-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$NAME: 2-CYANOETHYL-6-HYDROXY-2,5,7,8-TETRAMETHYL-3,4-DIHYDRO-2H-1-BENZOPYRAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H21NO2
CH$EXACT_MASS: 259.15723
CH$SMILES: N#CCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1
CH$IUPAC: InChI=1S/C16H21NO2/c1-10-11(2)15-13(12(3)14(10)18)6-8-16(4,19-15)7-5-9-17/h18H,5-8H2,1-4H3
CH$LINK: INCHIKEY YBRKMFFHXSYDJP-UHFFFAOYSA-N
AC$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: splash10-014i-1920000000-7a8654d74f26172e4acf
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  27 2 20
  28 1 10
  29 1 10
  39 0.3 3
  41 4 40
  43 6 60
  51 1 10
  53 0.6 6
  54 1 10
  55 10 100
  65 2 20
  67 0.3 3
  77 4 40
  79 2 20
  91 6 60
  93 0.1 1
  105 2 20
  107 2 20
  121 9 90
  122 0.2 2
  135 3 30
  136 8 80
  137 2 20
  163 0.1 1
  164 48 480
  165 99.99 999
  166 11 110
  177 0.4 4
  189 2 20
  203 2 20
  205 2 20
  258 0.1 1
  259 40 400
  260 7 70
//
