| SpectraBase Compound ID | 5JY0kePT40W |
|---|---|
| InChI | InChI=1S/C8H10FNS/c9-7-1-3-8(4-2-7)10-5-6-11/h1-4,10-11H,5-6H2 |
| InChIKey | XDVPEFZFQHGYDA-UHFFFAOYSA-N |
| Mol Weight | 171.23 g/mol |
| Molecular Formula | C8H10FNS |
| Exact Mass | 171.051799 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | C0BIIxtkkw |
|---|---|
| Name | 2-(p-Fluoroanilino)ethanethiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.051798663 u |
| Formula | C8H10FNS |
| InChI | InChI=1S/C8H10FNS/c9-7-1-3-8(4-2-7)10-5-6-11/h1-4,10-11H,5-6H2 |
| InChIKey | XDVPEFZFQHGYDA-UHFFFAOYSA-N |
| Molecular Weight | 171.233 g/mol |
| SMILES | N(C1=CC=C(F)C=C1)CCS |
| Spectrum/Structure Validation Score (Raman) | 0.730565 |