SpectraBase Compound ID | 9mdElFeEN9f |
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InChI | InChI=1S/C13H20O/c1-10(2)13(3,4)11-6-8-12(14-5)9-7-11/h6-10H,1-5H3 |
InChIKey | FFOMSPHTXJLLGU-UHFFFAOYSA-N |
Mol Weight | 192.3 g/mol |
Molecular Formula | C13H20O |
Exact Mass | 192.151415 g/mol |
SpectraBase Spectrum ID | KiuFhc1zTyq |
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Name | 2,3-Dimethyl-2-(4-methoxyphenyl)butane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 192.151415263 u |
Formula | C13H20O |
InChI | InChI=1S/C13H20O/c1-10(2)13(3,4)11-6-8-12(14-5)9-7-11/h6-10H,1-5H3 |
InChIKey | FFOMSPHTXJLLGU-UHFFFAOYSA-N |
Molecular Weight | 192.302 g/mol |
SMILES | CC(C(C)C)(C=1C=CC(=CC1)OC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921438 |