| SpectraBase Compound ID | 8UDD4o6Vgd0 |
|---|---|
| InChI | InChI=1S/C10H22O/c1-9(2,3)8(11-7)10(4,5)6/h8H,1-7H3 |
| InChIKey | MRUBMBKGFILSLG-UHFFFAOYSA-N |
| Mol Weight | 158.28 g/mol |
| Molecular Formula | C10H22O |
| Exact Mass | 158.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ExVvi09xz2H |
|---|---|
| Name | Pentane, 2,2,4,4-tetramethyl-3-methoxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.167065327 u |
| Formula | C10H22O |
| InChI | InChI=1S/C10H22O/c1-9(2,3)8(11-7)10(4,5)6/h8H,1-7H3 |
| InChIKey | MRUBMBKGFILSLG-UHFFFAOYSA-N |
| Molecular Weight | 158.285 g/mol |
| SMILES | COC(C(C)(C)C)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957728 |