Benzene-1,3-dicarbonitrile;1-methyl-4-nitrobenzene

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Benzene-1,3-dicarbonitrile;1-methyl-4-nitrobenzene
• 英文别名: benzene-1,3-dicarbonitrile;1-methyl-4-nitrobenzene
• 化学式: C15H11N3O2
• 分子量: 265.27
• InChiKey: BQSJCBYXUYZGLB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.33
• 重原子数：
  20
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  93.4
• 氢给体数：
  0
• 氢受体数：
  4

文献信息

• METHODS FOR THE ANALYSIS OF GLYCOPROTEINS OR GLYCOPEPTIDES BY MASS SPECTROMETRY
  申请人：Micromass UK Limited

  公开号：US20140099725A1

  公开（公告）日：2014-04-10

  A method for the analysis of samples including one or more glycopeptides including the steps of separating one or more glycopeptides using a chromatography system to produce a chromatographic eluent, adding a supercharging reagent to the chromatographic eluent, providing the chromatographic eluent and supercharging reagent to a mass spectrometer, ionizing said chromatographic eluent and supercharging reagent in an ion source to produce glycopeptide ions, performing at least one ion ion reaction on at least some of the glycopeptide ions to produce fragment ions, mass analyzing the fragment ions to produce ion ion reaction mass spectral data, and interpreting the ion ion reaction data mass spectral data to provide structural information relating to the glycopeptide.
• US9255906B2
  申请人：——

  公开号：US9255906B2

  公开（公告）日：2016-02-09