| SpectraBase Spectrum ID |
6KovttLo3A9 |
| Name |
Phthalic acid, 2-adamantyl cyclohexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.214409442 u |
| Formula |
C24H30O4 |
| InChI |
InChI=1S/C24H30O4/c25-23(27-19-6-2-1-3-7-19)20-8-4-5-9-21(20)24(26)28-22-17-11-15-10-16(13-17)14-18(22)12-15/h4-5,8-9,15-19,22H,1-3,6-7,10-14H2/t15-,16+,17-,18+,22? |
| InChIKey |
QFSBIOOCRGUVGB-WFVIJZHKSA-N |
| Molecular Weight |
382.500 g/mol |
| SMILES |
C1(=C(C=CC=C1)C(OC1CCCCC1)=O)C(OC1[C@]2(C[C@]3(C[C@@]1(C[C@@](C2)(C3)[H])[H])[H])[H])=O |
