SpectraBase Compound ID | 8epNwGfuQSN |
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InChI | InChI=1S/C16H34O/c1-5-9-10-12-15(8-4)16(17)13-14(7-3)11-6-2/h14-17H,5-13H2,1-4H3 |
InChIKey | OSGZPPIHWAXBGA-UHFFFAOYSA-N |
Mol Weight | 242.4 g/mol |
Molecular Formula | C16H34O |
Exact Mass | 242.260966 g/mol |
SpectraBase Spectrum ID | A4qpZ82KOst |
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Name | 5,8-Diethyl-6-dodecanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 242.260965714 u |
Formula | C16H34O |
InChI | InChI=1S/C16H34O/c1-5-9-10-12-15(8-4)16(17)13-14(7-3)11-6-2/h14-17H,5-13H2,1-4H3 |
InChIKey | OSGZPPIHWAXBGA-UHFFFAOYSA-N |
Molecular Weight | 242.447 g/mol |
SMILES | CCCC(CC(C(CCCCC)CC)O)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937513 |