| SpectraBase Compound ID | 37zb8EFx2q6 |
|---|---|
| InChI | InChI=1S/C9H19NO3/c1-8(2,10-11)6-7-9(3,12-4)13-5/h6-7H2,1-5H3 |
| InChIKey | OHJMCLVEJUQYHN-UHFFFAOYSA-N |
| Mol Weight | 189.25 g/mol |
| Molecular Formula | C9H19NO3 |
| Exact Mass | 189.136493 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DhR9WFvaqUq |
|---|---|
| Name | Hexane, 2,2-dimethoxy-5-methyl-5-nitroso- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.136493473 u |
| Formula | C9H19NO3 |
| InChI | InChI=1S/C9H19NO3/c1-8(2,10-11)6-7-9(3,12-4)13-5/h6-7H2,1-5H3 |
| InChIKey | OHJMCLVEJUQYHN-UHFFFAOYSA-N |
| Molecular Weight | 189.255 g/mol |
| SMILES | C(CCC(N=O)(C)C)(OC)(OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.843025 |