| SpectraBase Spectrum ID |
3HPK3Tun2o6 |
| Name |
(Z)-5-Fluoro-3'-(4-cyanophenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17FN2OS |
| InChI |
InChI=1S/C18H17FN2OS/c19-17-7-12-5-14(8-17)18(15(6-12)9-17)22-21-16(23-18)13-3-1-11(10-20)2-4-13/h1-4,12,14-15H,5-9H2/t12-,14-,15-,17-,18+/m1/s1 |
| InChIKey |
VBELBFVNFXIYRP-NHQZAOEJSA-N |
| Molecular Weight |
328.405 g/mol |
| SMILES |
[C@]12(SC(c3ccc(C#N)cc3)=NO1)[C@]1(C[C@]3(C[C@]2(C[C@](C3)(C1)[H])[H])F)[H] |
| SPLASH |
splash10-004i-1902000000-d961e7feeddc251e1df1 |
| Source of Spectrum |
J-64-1104-7 |
| Synonyms |
(E)-5-Fluoro-3'-(4-cyanophenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline) |
| Wiley ID |
1529377 |
