| SpectraBase Compound ID | Az4I4B9pmo0 |
|---|---|
| InChI | InChI=1S/C12H25NO/c1-3-5-6-7-9-12(8-4-2)13-10-11-14/h3,12-14H,1,4-11H2,2H3 |
| InChIKey | PRBLBODVTKFFDR-UHFFFAOYSA-N |
| Mol Weight | 199.34 g/mol |
| Molecular Formula | C12H25NO |
| Exact Mass | 199.193614 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4Fgweuv9arD |
|---|---|
| Name | 2-(1-Propylhept-6-enylamino)ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.193614428 u |
| Formula | C12H25NO |
| InChI | InChI=1S/C12H25NO/c1-3-5-6-7-9-12(8-4-2)13-10-11-14/h3,12-14H,1,4-11H2,2H3 |
| InChIKey | PRBLBODVTKFFDR-UHFFFAOYSA-N |
| Molecular Weight | 199.338 g/mol |
| SMILES | C(=C)CCCCC(NCCO)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884097 |