| SpectraBase Spectrum ID |
Hf5vqFu0F4H |
| Name |
6-Bromohexanoic acid, 1-adamantylmethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.119443107 u |
| Formula |
C17H27BrO2 |
| InChI |
InChI=1S/C17H27BrO2/c18-5-3-1-2-4-16(19)20-12-17-9-13-6-14(10-17)8-15(7-13)11-17/h13-15H,1-12H2/t13-,14+,15-,17- |
| InChIKey |
IMNYRXYAWKZCSG-LTBQPASTSA-N |
| Molecular Weight |
343.305 g/mol |
| SMILES |
[C@]12(CC3(C[C@](C2)(C[C@](C1)(C3)[H])[H])COC(=O)CCCCCBr)[H] |
