| SpectraBase Compound ID | 4vw5ZX4JD9c |
|---|---|
| InChI | InChI=1S/C12H12O/c1-13-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8H,9H2,1H3 |
| InChIKey | RRCDOVBQOMYGGJ-UHFFFAOYSA-N |
| Mol Weight | 172.23 g/mol |
| Molecular Formula | C12H12O |
| Exact Mass | 172.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2H2WZecCjln |
|---|---|
| Name | Naphthalene, 1-(methoxymethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.088815005 u |
| Formula | C12H12O |
| InChI | InChI=1S/C12H12O/c1-13-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8H,9H2,1H3 |
| InChIKey | RRCDOVBQOMYGGJ-UHFFFAOYSA-N |
| Molecular Weight | 172.227 g/mol |
| SMILES | C1=C2C=CC=C(C2=CC=C1)COC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916561 |