| SpectraBase Spectrum ID |
7iesa5GXj6R |
| Name |
(+-)-methyl 4,5,7,8-tetra-0-acetyl-2-0-benzyl-3-deoxy-D-manno-2-octulopyranosonate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
510.173726394 u |
| Formula |
C24H30O12 |
| InChI |
InChI=1S/C24H30O12/c1-14(25)31-13-20(34-16(3)27)22-21(35-17(4)28)19(33-15(2)26)11-24(36-22,23(29)30-5)32-12-18-9-7-6-8-10-18/h6-10,19-22H,11-13H2,1-5H3 |
| InChIKey |
KOWAWFXVEQSEBD-UHFFFAOYSA-N |
| Molecular Weight |
510.492 g/mol |
| SMILES |
C1(OC(C(OC(=O)C)C(C1)OC(=O)C)C(OC(=O)C)COC(=O)C)(C(=O)OC)OCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980439 |
