| SpectraBase Compound ID | FE5BDDtfJiM |
|---|---|
| InChI | InChI=1S/C18H18FNO/c1-4-20-17-10-9-15(21-3)11-16(17)12(2)18(20)13-5-7-14(19)8-6-13/h5-11H,4H2,1-3H3 |
| InChIKey | GOCBKBMTNLFIBV-UHFFFAOYSA-N |
| Mol Weight | 283.35 g/mol |
| Molecular Formula | C18H18FNO |
| Exact Mass | 283.137242 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | lpCaC2QaQD |
|---|---|
| Name | 1H-Indole, 1-ethyl-3-methyl-5-methoxy-2-(4-fluorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.137242366 u |
| Formula | C18H18FNO |
| InChI | InChI=1S/C18H18FNO/c1-4-20-17-10-9-15(21-3)11-16(17)12(2)18(20)13-5-7-14(19)8-6-13/h5-11H,4H2,1-3H3 |
| InChIKey | GOCBKBMTNLFIBV-UHFFFAOYSA-N |
| Molecular Weight | 283.346 g/mol |
| SMILES | CCN1C(C2=CC=C(F)C=C2)=C(C=2C1=CC=C(C2)OC)C |