ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007806
RECORD_TITLE: 6-CYANO-1,2,3,4-TETRAHYDRONAPHTHALENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 6-CYANO-1,2,3,4-TETRAHYDRONAPHTHALENE
CH$NAME: 6-CYANOTETRALIN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₁N
CH$EXACT_MASS: 157.08915
CH$SMILES: N#Cc(c1)cc(C2)c(CCC2)c1
CH$IUPAC: InChI=1S/C11H11N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h5-7H,1-4H2
CH$LINK: COMPTOX DTXSID70342489
CH$LINK: INCHIKEY TWDAXWPAXMGRAF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:582354

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-004i-2900000000-4494c0c87a46d6f88507
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  27 1.82 18
  29 3.41 34
  39 7.51 75
  41 2.16 22
  44 10.01 100
  50 4.01 40
  51 7.53 75
  63 9.21 92
  64 4.01 40
  75 1.03 10
  77 7.11 71
  89 4.55 46
  102 6.54 65
  103 5.01 50
  115 5.07 51
  116 30.51 305
  129 99.99 999
  130 11.01 110
  141 1.09 11
  142 15.04 150
  157 45.51 455
  158 2.01 20
//