| SpectraBase Compound ID | 9QbSDWGPawe |
|---|---|
| InChI | InChI=1S/C9H10FNO3/c1-6(11(13)14)9(12)7-4-2-3-5-8(7)10/h2-6,9,12H,1H3 |
| InChIKey | ZEOLJLDCYNVQTL-UHFFFAOYSA-N |
| Mol Weight | 199.18 g/mol |
| Molecular Formula | C9H10FNO3 |
| Exact Mass | 199.064471 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JGPsGEaMqzh |
|---|---|
| Name | 1-(2'-Fluorophenyl)-2-nitro-1-propanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.064471346 u |
| Formula | C9H10FNO3 |
| InChI | InChI=1S/C9H10FNO3/c1-6(11(13)14)9(12)7-4-2-3-5-8(7)10/h2-6,9,12H,1H3 |
| InChIKey | ZEOLJLDCYNVQTL-UHFFFAOYSA-N |
| Molecular Weight | 199.181 g/mol |
| SMILES | C(C([N+](=O)[O-])C)(C=1C(=CC=CC1)F)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959567 |