| SpectraBase Spectrum ID |
L6akVTpbmX7 |
| Name |
D-Manno-D-manno-dodec-6-enitol, 3,6:7,10-dianhydro-1,2:4,5:8,9:11,12-tetrakis-o-(1-methylethylidene)- , (Z)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
484.230847349 u |
| Formula |
C24H36O10 |
| InChI |
InChI=1S/C24H36O10/c1-21(2)25-9-11(29-21)13-17-19(33-23(5,6)31-17)15(27-13)16-20-18(32-24(7,8)34-20)14(28-16)12-10-26-22(3,4)30-12/h11-14,17-20H,9-10H2,1-8H3/b16-15+/t11-,12+,13?,14?,17-,18+,19-,20+ |
| InChIKey |
HSGBWFHTUZIEIM-QJGGJCMRSA-N |
| Molecular Weight |
484.542 g/mol |
| SMILES |
[C@]12(\C(=C\3[C@@]4([C@](OC(O4)(C)C)(C(O3)[C@@]3(OC(C)(C)OC3)[H])[H])[H])OC([C@@]2(OC(O1)(C)C)[H])[C@]1(OC(C)(C)OC1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87189 |
