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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009600

METHYL 2-NAPHTHYL KETONE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009600
RECORD_TITLE: METHYL 2-NAPHTHYL KETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: THE INSTITUTE OF SCIENTIFIC AND INDUSTRIALRESEARCH
LICENSE: CC BY-NC-SA

CH$NAME: METHYL 2-NAPHTHYL KETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H10O
CH$EXACT_MASS: 170.07316
CH$SMILES: CC(=O)c(c1)cc(c2)c(ccc2)c1
CH$IUPAC: InChI=1S/C12H10O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H3
CH$LINK: INCHIKEY XSAYZAUNJMRRIR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2041389

AC$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-004j-2900000000-78879a4ce433795813fc
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  27 2.2 22
  28 7.5 75
  29 1 10
  32 0.18 2
  38 1 10
  39 3.8 38
  42 3.7 37
  43 2.69 27
  50 4.7 47
  51 7.1 71
  52 1.2 12
  62 0.27 3
  63 8.5 85
  64 3.7 37
  74 6.8 68
  75 0.97 10
  76 5 50
  77 12.9 129
  78 2 20
  86 0.18 2
  87 3.8 38
  89 1.8 18
  98 2.3 23
  99 0.22 2
  100 2.1 21
  101 9.7 97
  102 2.2 22
  115 0.51 5
  125 1.7 17
  126 24.3 243
  127 99.99 999
  128 1.5 15
  139 3 30
  141 2.6 26
  145 84.7 847
  146 1.07 11
  170 33.2 332
  171 4.5 45
//

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