| SpectraBase Spectrum ID |
1VGzFyHYypO |
| Name |
Dimethyl 4,5-di(1-adamantyl)phthalate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
462.277009700 u |
| Formula |
C30H38O4 |
| InChI |
InChI=1S/C30H38O4/c1-33-27(31)23-9-25(29-11-17-3-18(12-29)5-19(4-17)13-29)26(10-24(23)28(32)34-2)30-14-20-6-21(15-30)8-22(7-20)16-30/h9-10,17-22H,3-8,11-16H2,1-2H3 |
| InChIKey |
JZKNBBZEPJQHSQ-UHFFFAOYSA-N |
| Molecular Weight |
462.630 g/mol |
| SMILES |
C12(C3=C(C45CC6CC(C5)CC(C4)C6)C=C(C(=C3)C(=O)OC)C(=O)OC)CC3CC(C2)CC(C1)C3 |
