| SpectraBase Compound ID | 899gAS31v5e |
|---|---|
| InChI | InChI=1S/C10H11NO3/c1-7(2)6-8-4-3-5-9(10(8)12)11(13)14/h3-5,12H,1,6H2,2H3 |
| InChIKey | MBISKJZSPFHJSO-UHFFFAOYSA-N |
| Mol Weight | 193.2 g/mol |
| Molecular Formula | C10H11NO3 |
| Exact Mass | 193.073893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GcqC8dMYpct |
|---|---|
| Name | 2-(2-Methylallyl)-6-nitrophenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.073893215 u |
| Formula | C10H11NO3 |
| InChI | InChI=1S/C10H11NO3/c1-7(2)6-8-4-3-5-9(10(8)12)11(13)14/h3-5,12H,1,6H2,2H3 |
| InChIKey | MBISKJZSPFHJSO-UHFFFAOYSA-N |
| Molecular Weight | 193.202 g/mol |
| SMILES | C1(N(=O)=O)=C(C(CC(=C)C)=CC=C1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973511 |