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一个免费的26800个NMR图谱网站

核磁谱图交流

  • 这是我7年来经常使用的最大的免费的NMR图谱网站.向大家推荐,我想大家一定会喜欢的.该图谱数据库是我见到的最大的免费数据库,可以简单地按搜索窗口进入关键词来检索,使用方便.如果您的专业英文(化合物命名)比较熟练,那就更好了.该图谱数据库的检索方式不可避免地存在缺陷,比如,实际上库里有你要找的化合物,但你输入分子式或化合物名反而找不到,那就换个方式查找.
    http://www.aist.go.jp/RIODB/SDBS/cgi-bin/direct_frame_top.cgi?lang=eng

    SDBS is an integrated spectral database system for organic compounds,which includes 6 different types of spectra under a directory of the compounds. The six spectra are as follows, an electron impact Mass spectrum (EI-MS), a Fourier transform infrared spectrum (FT-IR), a 1H nuclear magnetic resonance (NMR) spectrum, a 13C NMR spectrum, a laser Raman spectrum, and an electron spin resonance (ESR) spectrum. We started the studies on the spectral database system in early 1970s. The construction of the database in the present format was started in 1982 in a mainframe computer that was finished at the end of March 1999. In 2001, National Metrology Institute of Japan (NMIJ) under National Institute of Advanced Industrial Science and technology (AIST) started to manage and to maintain the SDBS. Currently, EI-MS spectrum, 1H NMR spectrum, 13C NMR spectrum, FT-IR spectrum, and the compound dictionary are active for correcting and maintenance of the data. Since 1997, SDBS has opened to the public with free of charge through TACC (Tsukuba Advanced Computing Center) as RIO-DB (Research Information Data Base). The total accumulated number of access almost reached 146 million at the end of August 2006. SDBS is a fact database that contains spectral pattern and has been an important database that sends information from Japan to all over the world. The numbers of the data present at the end of September 2004 were as follows.

    Compounds: ca 32800 compounds updated
    MS: ca 23500 spectra updated
    1H NMR: ca 14300 spectra updated
    13C NMR: ca 12500 spectra updated
    FT-IR: ca 50500 spectra updated
    Raman: ca 3500 spectra
    ESR: ca 2500 spectra
  • 该帖子已被管理者-celan设置为精华,下面是奖励记录:加5积分,加5声望
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  • 第1楼2005/04/28

    你是NMR专家吧,总能给大家一些好东西,谢谢,我也去看看

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  • 第3楼2005/09/29

    挺实用的网址.
    输入化合物名字后 (例如 tetrahydrofuran), 会自动给出分子式/分子量以及 CA 登记号, 然后表列是否有以下谱库: MS, CNMR, HNMR, IR, Raman, ESR
    若有, 点击便得到谱图. 十分方便. 用来练习解谱也很合适.

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  • 该帖子已被管理者-设置为精华,下面是奖励记录:加5积分,加5声望
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  • 第4楼2005/10/02

    不错啊,可惜我要到几个都没有,还是很感谢

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  • 第5楼2005/10/02

    我已经用了一段时间了

    确实挺好用的

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  • 第7楼2005/11/04

    没有我要找得!可惜!!!!

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  • 第9楼2005/11/21

    谢谢!非常好用!如果再有放大后的氢谱就更完美了!就是多重峰放大的。

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