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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006740

N-(3-PHENYLBUTYRYL)PIPERIDIN-2-ONE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006740
RECORD_TITLE: N-(3-PHENYLBUTYRYL)PIPERIDIN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: N-(3-PHENYLBUTYRYL)PIPERIDIN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H19NO2
CH$EXACT_MASS: 245.14158
CH$SMILES: O=C(C2)N(CCC2)C(=O)CC(C)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H19NO2/c1-12(13-7-3-2-4-8-13)11-15(18)16-10-6-5-9-14(16)17/h2-4,7-8,12H,5-6,9-11H2,1H3
CH$LINK: INCHIKEY XLBJPDXJCDNABW-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI RMU-6G
AC$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$SPLASH: splash10-0uxr-1900000000-fdea994c9b38d45e5781
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
  41 4 40
  42 1.3 13
  43 2.2 22
  44 1.3 13
  55 3.1 31
  56 2.1 21
  57 1.5 15
  70 1 10
  71 2.8 28
  76 1.8 18
  78 2.2 22
  79 2 20
  82 3 30
  84 1 10
  91 5 50
  98 5.3 53
  99 17.5 175
  100 99.99 999
  101 6.5 65
  102 0.5 5
  103 3.8 38
  104 2.5 25
  105 33 330
  106 3.5 35
  107 0.5 5
  112 10 100
  113 2.8 28
  114 0.5 5
  115 0.5 5
  116 1 10
  117 7 70
  118 71 710
  119 10 100
  131 17 170
  132 1.8 18
  140 4.5 45
  141 1.5 15
  145 8 80
  146 11 110
  147 1.8 18
  164 1.3 13
  174 1.7 17
  175 1.2 12
  179 0.8 8
  230 4 40
  245 19 190
  246 5.2 52
  247 0.6 6
//

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