SpectraBase Compound ID | 8C4eCfAzZSq |
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InChI | InChI=1S/C16H26O/c1-5-12(6-2)14-10-9-11-15(16(14)17)13(7-3)8-4/h9-13,17H,5-8H2,1-4H3 |
InChIKey | YDXKENQBUINNJH-UHFFFAOYSA-N |
Mol Weight | 234.38 g/mol |
Molecular Formula | C16H26O |
Exact Mass | 234.198365 g/mol |
SpectraBase Spectrum ID | H6QyiyIdUbD |
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Name | 2,6-bis(1-Ethylpropyl)phenol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 234.198365456 u |
Formula | C16H26O |
InChI | InChI=1S/C16H26O/c1-5-12(6-2)14-10-9-11-15(16(14)17)13(7-3)8-4/h9-13,17H,5-8H2,1-4H3 |
InChIKey | YDXKENQBUINNJH-UHFFFAOYSA-N |
Molecular Weight | 234.383 g/mol |
SMILES | C=1(C(=CC=CC1C(CC)CC)C(CC)CC)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.891853 |