SpectraBase Compound ID | 2coaMNAMaB7 |
---|---|
InChI | InChI=1S/C16H34O/c1-4-6-7-8-9-10-11-12-13-14-16(3,5-2)15-17/h17H,4-15H2,1-3H3 |
InChIKey | RHGHBLSDPQFOTE-UHFFFAOYSA-N |
Mol Weight | 242.4 g/mol |
Molecular Formula | C16H34O |
Exact Mass | 242.260966 g/mol |
SpectraBase Spectrum ID | HQk6Ksf8dkR |
---|---|
Name | Tridecanol, 2-ethyl-2-methyl- |
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/c1-4-6-7-8-9-10-11-12-13-14-16(3,5-2)15-17/h17H,4-15H2,1-3H3 |
InChIKey | RHGHBLSDPQFOTE-UHFFFAOYSA-N |
Molecular Weight | 242.447 g/mol |
SMILES | C(CCCCCCCCCC(C)(CC)CO)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.907126 |