| SpectraBase Compound ID | 7tgLY7NH4bW |
|---|---|
| InChI | InChI=1S/C15H31NO/c1-12(2)8-7-9-14(5)16(15(6)17)11-10-13(3)4/h12-14H,7-11H2,1-6H3 |
| InChIKey | GKIGZKITKBUPNI-UHFFFAOYSA-N |
| Mol Weight | 241.42 g/mol |
| Molecular Formula | C15H31NO |
| Exact Mass | 241.240565 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CsZaTpDhEPa |
|---|---|
| Name | Octamylamine ac P562 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.240564621 u |
| Formula | C15H31NO |
| InChI | InChI=1S/C15H31NO/c1-12(2)8-7-9-14(5)16(15(6)17)11-10-13(3)4/h12-14H,7-11H2,1-6H3 |
| InChIKey | GKIGZKITKBUPNI-UHFFFAOYSA-N |
| Molecular Weight | 241.419 g/mol |
| SMILES | CC(CCCC(N(C(=O)C)CCC(C)C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890531 |