| SpectraBase Compound ID | 7rF5n2jNDbP |
|---|---|
| InChI | InChI=1S/C15H23NOS/c1-5-8-16-9-7-13-11-15(18-4)12(6-2)10-14(13)17-3/h5,10-11,16H,1,6-9H2,2-4H3 |
| InChIKey | FUZLFMKBLMQCDN-UHFFFAOYSA-N |
| Mol Weight | 265.41 g/mol |
| Molecular Formula | C15H23NOS |
| Exact Mass | 265.150036 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5BmZ2g1H5yX |
|---|---|
| Name | 2C-5-Toet all |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.150035538 u |
| Formula | C15H23NOS |
| InChI | InChI=1S/C15H23NOS/c1-5-8-16-9-7-13-11-15(18-4)12(6-2)10-14(13)17-3/h5,10-11,16H,1,6-9H2,2-4H3 |
| InChIKey | FUZLFMKBLMQCDN-UHFFFAOYSA-N |
| Molecular Weight | 265.415 g/mol |
| SMILES | C=1(C(=CC(=C(C1)SC)CC)OC)CCNCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954955 |