| SpectraBase Compound ID | 8PenA2ZsNN5 |
|---|---|
| InChI | InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5?,7?/m1/s1 |
| InChIKey | AAWZDTNXLSGCEK-LNVDRNJUSA-N |
| Mol Weight | 192.17 g/mol |
| Molecular Formula | C7H12O6 |
| Exact Mass | 192.063388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 25uNECDpECp |
|---|---|
| Name | D-(-)-Quinic acid |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 138622 |
| CAS Registry Number | 77-95-2 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O6 |
| InChI | InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5?,7?/m1/s1 |
| InChIKey | AAWZDTNXLSGCEK-LNVDRNJUSA-N |
| Observed nucleus | 13C |
| Purity | 98% |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_001133 |