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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003824

PHENSUXIMIDE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003824
RECORD_TITLE: PHENSUXIMIDE; 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$NAME: PHENSUXIMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H11NO2
CH$EXACT_MASS: 189.07898
CH$SMILES: O=C(C1)N(C)C(=O)C1c(c2)cccc2
CH$IUPAC: InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
CH$LINK: INCHIKEY WLWFNJKHKGIJNW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4023460

AC$INSTRUMENT: Unknown
AC$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$SPLASH: splash10-0udi-3900000000-3ea0132a234fd8153646
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  26 1.9 19
  27 4.9 49
  28 4.9 49
  29 0.19 2
  39 5.9 59
  42 1.4 14
  50 5.9 59
  51 1.39 14
  52 4.9 49
  56 2.4 24
  57 0.9 9
  58 0.14 1
  62 2.4 24
  63 4.4 44
  64 1.4 14
  65 0.01 0
  74 2.9 29
  75 2.4 24
  76 3.4 34
  77 1.34 13
  78 13.4 134
  79 1.4 14
  89 2.4 24
  90 0.14 1
  91 1.4 14
  102 4.4 44
  103 17.4 174
  104 99.99 999
  105 12.4 124
  189 25.9 259
  190 2.9 29
//

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