| SpectraBase Compound ID | 1Wr9mokQmfr |
|---|---|
| InChI | InChI=1S/C11H15NOS/c1-2-3-9-13-11(14)12-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,12,14) |
| InChIKey | AFLJZONKLOTDEJ-UHFFFAOYSA-N |
| Mol Weight | 209.31 g/mol |
| Molecular Formula | C11H15NOS |
| Exact Mass | 209.087435 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CpCMkf6vs9f |
|---|---|
| Name | N-Phenyl,N-butyl-thiocarbamate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.087435280 u |
| Formula | C11H15NOS |
| InChI | InChI=1S/C11H15NOS/c1-2-3-9-13-11(14)12-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,12,14) |
| InChIKey | AFLJZONKLOTDEJ-UHFFFAOYSA-N |
| Molecular Weight | 209.307 g/mol |
| SMILES | C(OC(=S)NC1=CC=CC=C1)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.891829 |