| SpectraBase Spectrum ID |
dwsTU4HZxi |
| Name |
Tetrahydropyran-2,4,5-triol-6-methanol-3-amine, N,N-diacetyl, 2,6-diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.132195935 u |
| Formula |
C16H23NO10 |
| InChI |
InChI=1S/C16H23NO10/c1-7(18)17(8(2)19)13-15(25-10(4)21)14(23)12(6-24-9(3)20)27-16(13)26-11(5)22/h12-16,23H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1 |
| InChIKey |
ODCONZVKLPSRGO-IBEHDNSVSA-N |
| Molecular Weight |
389.357 g/mol |
| SMILES |
[C@]1([C@](O[C@]([C@@]([C@]1(OC(=O)C)[H])(N(C(=O)C)C(=O)C)[H])(OC(C)=O)[H])(COC(C)=O)[H])(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975578 |
