|
| ID | Structure | Type | File | Submitted | Open Data | Comments |
| 48 |  | CNMR | expnmr_00094_3_000000fid.jdx | 01/07/2008 23:52:49 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 48 | | HNMR | expnmr_00094_1_000000fid.jdx | 01/07/2008 23:52:07 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 50 |  | CNMR | expnmr_00021_3_000000fid.jdx | 02/06/2008 23:13:37 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 50 | | HNMR | expnmr_00021_1_000000fid.jdx | 02/06/2008 23:12:15 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, I. A. et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 83 |  | CNMR | expnmr_00170_3_000000fid.jdx | 02/08/2008 16:08:07 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008). Deposited by Chris Singleton, Chemspider Advisory Group. |
| 83 | | HNMR | expnmr_00170_1_000000fid.jdx | 02/08/2008 16:06:46 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008). Deposited by Chris Singleton, Chemspider Advisory Group. |
| 132 |  | CNMR | expnmr_00060_3_000000fid.jdx | 13/06/2008 16:38:31 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 132 | | HNMR | expnmr_00060_1_000000fid.jdx | 13/06/2008 16:37:46 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 171 |  | Infrared | acetic acid IR.jdx | 16/04/2009 21:42:02 | True | Sourced, with permission, from the NIST Webbook |
| 172 |  | CNMR | ethanal_c.jdx | 10/08/2007 00:46:08 | True | This data was aquired on the Widener University QE-300 NMR by Dr Scott E. Van Bramer. These files may be freely used for educational purposes provided that the original source is acknowledged. Many of these compounds are student samples, and they may include some impurities. |
| 172 | | HNMR | ethanal_h.jdx | 10/08/2007 00:45:37 | True | This data was aquired on the Widener University QE-300 NMR by Dr Scott E. Van Bramer. These files may be freely used for educational purposes provided that the original source is acknowledged. Many of these compounds are student samples, and they may include some impurities. |
| 172 | | Infrared | acetaldehyde_IR.JDX | 16/04/2009 14:17:42 | True | Sourced, with permission, from the NIST Webbook |
| 175 |  | Infrared | acetone_ir.jdx | 16/04/2009 14:05:44 | True | Sourced, with permission, from the NIST webbook |
| 185 |  | CNMR | expnmr_00004_3_000000fid.jdx | 27/05/2008 16:08:34 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, I. A. et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 185 | | HNMR | expnmr_00004_1_000000fid.jdx | 27/05/2008 16:07:50 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, I. A. et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 186 |  | CNMR | expnmr_00005_3_000000fid.jdx | 27/05/2008 16:19:48 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 186 | | HNMR | expnmr_00005_1_000000fid.jdx | 27/05/2008 16:13:27 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, I. A. et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) |
| 191 |  | CNMR | adipic acid C.jdx | 15/02/2009 09:57:35 | True | These data are obtained from the Pacific Lutheran University FTNMR FID Archive |
| 191 | | HNMR | adipic acid H.jdx | 16/02/2009 18:28:31 | True | These data are obtained from the Pacific Lutheran University FTNMR FID Archive |
| 192 |  | CNMR | expnmr_00007_3_000000fid.jdx | 27/05/2008 16:36:04 | True | Madison Metabolomics Consortium Database Spectrum, Q. Cui, et al; "Metabolite identification via the Madison Metabolomics Consortium Database", Nature Biotechnology, 26,162 (2008) Spectrum is for disodium salt. |
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