| SpectraBase Spectrum ID |
4UukgTCIaa1 |
| Name |
(E)-1-(1-Adamantyl)-4,4-difluoro-3-(1-hydroxycyclopropyl)-2-buten-1-one |
| Alternate Name(s) |
(E)-1-(1-adamantyl)-4,4-bis(fluoranyl)-3-(1-oxidanylcyclopropyl)but-2-en-1-one
(E)-1-(1-adamantyl)-4,4-difluoro-3-(1-hydroxycyclopropyl)but-2-en-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22F2O2 |
| InChI |
InChI=1S/C17H22F2O2/c18-15(19)13(17(21)1-2-17)6-14(20)16-7-10-3-11(8-16)5-12(4-10)9-16/h6,10-12,15,21H,1-5,7-9H2/b13-6-/t10-,11+,12-,16- |
| InChIKey |
CXKIDLDZUKYQCR-GTCGWTQQSA-N |
| Molecular Weight |
296.358 g/mol |
| SMILES |
OC1(\C(=C/C(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])=O)C(F)F)CC1 |
| SPLASH |
splash10-00ko-9340000000-ebbbd68ea55dec3f3f0b |
| Source of Spectrum |
K1-2004-3152-27 |
| Wiley ID |
1561255 |
