| SpectraBase Compound ID | 8SjrvZ5QsCR |
|---|---|
| InChI | InChI=1S/C11H8O3/c1-6-4-10(13)9-5-7(12)2-3-8(9)11(6)14/h2-5,12H,1H3 |
| InChIKey | MREWLSAUCCIYOO-UHFFFAOYSA-N |
| Mol Weight | 188.18 g/mol |
| Molecular Formula | C11H8O3 |
| Exact Mass | 188.047344 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 91HzdM49ubn |
|---|---|
| Name | 6-Hydroxy-2-methyl-1,4-naphthoquinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.047344115 u |
| Formula | C11H8O3 |
| InChI | InChI=1S/C11H8O3/c1-6-4-10(13)9-5-7(12)2-3-8(9)11(6)14/h2-5,12H,1H3 |
| InChIKey | MREWLSAUCCIYOO-UHFFFAOYSA-N |
| Molecular Weight | 188.182 g/mol |
| SMILES | C1=2C(C(C)=CC(C2C=C(C=C1)O)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939825 |