SDBS简介(有机波谱分析) (1)

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英文版本
日文版本
AIST:RIO-DB spectral Database for Organic Compounds,SDBS
3、SDBS查询（简单有机物CH4）
搜索结果
H谱
分子式确定
C7H8有机化合物查找结果（复杂类）
MS
C谱
The synopsis of SDBS
• 1.SDBS is an integrated spectral database system for organic compounds, which includes 6 different types of spectra under a directory database of the compounds. The spectra are EI mass, 1H decoupled 13C NMR, 1H NMR pattern (90 and/or 400 MHz), 1H NMR parameter (300 MHz pattern generated), FT-IR, laser-Raman, and ESR. We started the studies on the spectral database system in early 1970. The construction of the database in the present format was started in 1982 in a main-frame computer which was finished at the end of March, 1999. At present, the activities to add new data and update the previous data are still continuing using WS or PC. The numbers of the data for each type of spectra at the end of March, 1999 are as follows. • 2.MS (ca 19,600 spectra)、13C NMR (ca 11,000 spectra)、 Compound Dictionary 1H NMR (ca 13,500 spectra) 、（30,000 compounds) IR (ca 47,300 spectra)、Raman (ca 3,500 spectra)、 ESR (ca 2,000 spectra)
Raman
ESR
H谱
பைடு நூலகம்
peak data
分子式确定
IR
总结
• 分子量越小，查找越精确； • 多碳的有机化合物，条件越多，查找 越精确。
SDBS简介 • 由National Institute of Materials and Chemical Research (NIMC)研制，是关于 有机化合物的光谱的综合性数据库， 俗称 NIMC有机物谱图库 ，包括有机化合物的质 谱(19600张谱图)，H1核磁共振谱(13500张 谱图)，C13核磁共振谱(11000张谱图)，红 外光谱(47300张谱图)，拉曼光谱(3500张 谱图)，电子自旋共振谱(2000张谱图)6种谱 图数据.应用范围广泛，如有机化学、分析 化学 -- 质谱分析、波谱分析、 光谱分析