| SpectraBase Compound ID | p3gSiiQ7rW |
|---|---|
| InChI | InChI=1S/C10H13NO3/c1-8(2)7-14-10-5-3-9(4-6-10)11(12)13/h3-6,8H,7H2,1-2H3 |
| InChIKey | WCRILJGXNFOWEG-UHFFFAOYSA-N |
| Mol Weight | 195.22 g/mol |
| Molecular Formula | C10H13NO3 |
| Exact Mass | 195.089543 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KiQnyptJV2u |
|---|---|
| Name | 4-Nitrophenol, 2-methylpropyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.089543280 u |
| Formula | C10H13NO3 |
| InChI | InChI=1S/C10H13NO3/c1-8(2)7-14-10-5-3-9(4-6-10)11(12)13/h3-6,8H,7H2,1-2H3 |
| InChIKey | WCRILJGXNFOWEG-UHFFFAOYSA-N |
| Molecular Weight | 195.218 g/mol |
| SMILES | C1=CC(=CC=C1OCC(C)C)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920291 |