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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000481

1,4-DIMETHYLPIPERIDINE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000481
RECORD_TITLE: 1,4-DIMETHYLPIPERIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 1,4-DIMETHYLPIPERIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H15N
CH$EXACT_MASS: 113.12045
CH$SMILES: CC(C1)CCN(C)C1
CH$IUPAC: InChI=1S/C7H15N/c1-7-3-5-8(2)6-4-7/h7H,3-6H2,1-2H3
CH$LINK: INCHIKEY TVSMLBGFGKLKOO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID50219726

AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-03dl-9400000000-f65264ea885dd4651250
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  18 9.3 93
  26 2.3 23
  27 14.4 144
  29 0.8 8
  30 3.9 39
  38 1.1 11
  39 12.7 127
  40 0.23 2
  41 22.4 224
  42 51 510
  43 57.1 571
  45 0.15 2
  50 1 10
  51 1.9 19
  52 1.7 17
  53 0.45 5
  54 4 40
  55 14.8 148
  56 6.3 63
  57 1.39 14
  58 17.8 178
  59 1.2 12
  65 1.3 13
  66 0.11 1
  68 3.3 33
  69 4.6 46
  70 40 400
  71 1.41 14
  72 1.3 13
  77 1 10
  78 1.2 12
  79 0.1 1
  80 1.8 18
  81 2.2 22
  82 3.5 35
  83 0.14 1
  84 3.3 33
  85 1.4 14
  94 2.2 22
  96 0.61 6
  97 1.3 13
  98 14.1 141
  99 1.6 16
  110 0.18 2
  111 2 20
  112 99.99 999
  113 45 450
  114 0.32 3
  127 1.4 14
//

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