| SpectraBase Compound ID | AsNhv0GoCCi |
|---|---|
| InChI | InChI=1S/C10H13ClO/c1-2-3-7-12-10-6-4-5-9(11)8-10/h4-6,8H,2-3,7H2,1H3 |
| InChIKey | YWHVUFQZZLLMSR-UHFFFAOYSA-N |
| Mol Weight | 184.67 g/mol |
| Molecular Formula | C10H13ClO |
| Exact Mass | 184.065493 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2IEe3DdjFkh |
|---|---|
| Name | 3-Chlorophenol, N-butyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.065492738 u |
| Formula | C10H13ClO |
| InChI | InChI=1S/C10H13ClO/c1-2-3-7-12-10-6-4-5-9(11)8-10/h4-6,8H,2-3,7H2,1H3 |
| InChIKey | YWHVUFQZZLLMSR-UHFFFAOYSA-N |
| Molecular Weight | 184.666 g/mol |
| SMILES | C1=C(C=CC=C1OCCCC)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940713 |