| SpectraBase Spectrum ID |
5CxMg1xcr9q |
| Name |
5-methoxy-3-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfanyl)-1H-indole |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.018288522 u |
| Formula |
C13H8F9NOS |
| InChI |
InChI=1S/C13H8F9NOS/c1-24-6-2-3-8-7(4-6)9(5-23-8)25-13(21,22)11(16,17)10(14,15)12(18,19)20/h2-5,23H,1H3 |
| InChIKey |
UWYIMGPKWWDHHX-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200885 |
| Molecular Weight |
397.259 g/mol |
| Quality |
245 |
| Reported Formula |
C13H8F9NOS |
| SMILES |
N1C=C(C=2C=C(C=CC12)OC)SC(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
| SPLASH |
splash10-004i-2904000000-4998e6e5f1d8474e2203 |
| Source of Spectrum |
K1-2022-SM5-3g (DOI: 10.1002/ejoc.202200885) |
| Wiley ID |
1898908 |
