| SpectraBase Compound ID | CWzdTD24ym7 |
|---|---|
| InChI | InChI=1S/C11H8N2S/c12-7-14-11-6-5-10(13)8-3-1-2-4-9(8)11/h1-6H,13H2 |
| InChIKey | DZLYNBPEWVARRV-UHFFFAOYSA-N |
| Mol Weight | 200.26 g/mol |
| Molecular Formula | C11H8N2S |
| Exact Mass | 200.040819 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EmO2kjfG1hw |
|---|---|
| Name | Thiocyanic acid, 4-amino-1-naphthyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.040819440 u |
| Formula | C11H8N2S |
| InChI | InChI=1S/C11H8N2S/c12-7-14-11-6-5-10(13)8-3-1-2-4-9(8)11/h1-6H,13H2 |
| InChIKey | DZLYNBPEWVARRV-UHFFFAOYSA-N |
| SMILES | NC=1C2=C(C=CC=C2)C(=CC1)SC#N |
| Spectrum/Structure Validation Score (Raman) | 0.920176 |