MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007827

1,2-DIMETHYLINDOLE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007827
RECORD_TITLE: 1,2-DIMETHYLINDOLE; 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

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CH$NAME: 1,2-DIMETHYLINDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₁N
CH$EXACT_MASS: 145.08915
CH$SMILES: Cc(c([H])1)n(C)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C10H11N/c1-8-7-9-5-3-4-6-10(9)11(8)2/h3-7H,1-2H3
CH$LINK: CAS 875-79-6
CH$LINK: INCHIKEY BJMUOUXGBFNLSN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00236367

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0005-1900000000-e72e246997bbecc2a13c
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  39 5.78 58
  42 1.62 16
  51 6.52 65
  52 2.01 20
  71.5 7.52 75
  72.5 12.52 125
  77 13.02 130
  89 5.01 50
  102 6.32 63
  103 9.02 90
  115 13.54 135
  116 3.96 40
  128 7.02 70
  130 7.02 70
  144 95.1 951
  145 99.99 999
  146 12.52 125
  147 1.01 10
//