Shikimic acid.hsqc
Dataset description:
This dataset contains NMR spectra obtained for the sample -Shikimic acid date: 2007-10-25T16:02:06.000Z isFt: true name: Shikimic acid/1 phc0: 93.98719 phc1: -14.4 type: NMR FID DECIM: 24...
Source: Shikimic acid.hsqc
Chemical Info
| InChI | InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5+,6+/m0/s1 |
|---|---|
| SMILES | O=C(O)C1=C[C@H](O)[C@@H](O)[C@H](O)C1 |
| InChI Key | JXOHGGNKMLTUBP-KVQBGUIXSA-N |
| Molecular Formula | C7H10O5 |
| Exact Mass | 174.150 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | April 22, 2024 |
| Metadata last updated | April 22, 2024 |
| Created | April 22, 2024 |
| Format | HTML |
| License | Attribution 4.0 International |
| Id | 0b2cdb5b-9f2a-402c-848b-be3e4674f4ef |
| Package id | nmrxiv-d1428 |
| Resource type | HTML |
| State | active |