| SpectraBase Compound ID | 1hr0a51XSXC |
|---|---|
| InChI | InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9-,10+,11-,12+/m1/s1 |
| InChIKey | MIAKOEWBCMPCQR-ZIQFBCGOSA-N |
| Mol Weight | 271.27 g/mol |
| Molecular Formula | C12H17NO6 |
| Exact Mass | 271.105587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JixNmwc8Xhk |
|---|---|
| Name | p-Aminophenyl-alpha-D-glucopyranoside |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.105587265 u |
| Formula | C12H17NO6 |
| InChI | InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9-,10+,11-,12+/m1/s1 |
| InChIKey | MIAKOEWBCMPCQR-ZIQFBCGOSA-N |
| SMILES | OC[C@@]1([C@]([C@@]([C@]([C@](O1)(OC=1C=CC(=CC1)N)[H])(O)[H])(O)[H])(O)[H])[H] |