| SpectraBase Compound ID | KXHAsExeoOp |
|---|---|
| InChI | InChI=1S/C11H24O/c1-4-6-7-8-9-10-11(5-2)12-3/h11H,4-10H2,1-3H3 |
| InChIKey | WTQMTAKGPZZDKP-UHFFFAOYSA-N |
| Mol Weight | 172.31 g/mol |
| Molecular Formula | C11H24O |
| Exact Mass | 172.182715 g/mol |
| SpectraBase Spectrum ID | AiuLKnICxs |
|---|---|
| Name | Decane, 3-methoxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.182715392 u |
| Formula | C11H24O |
| InChI | InChI=1S/C11H24O/c1-4-6-7-8-9-10-11(5-2)12-3/h11H,4-10H2,1-3H3 |
| InChIKey | WTQMTAKGPZZDKP-UHFFFAOYSA-N |
| Molecular Weight | 172.312 g/mol |
| SMILES | C(C(CC)OC)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.882998 |