| SpectraBase Compound ID | J8WeNmMzEQB |
|---|---|
| InChI | InChI=1S/C16H35N/c1-3-5-7-9-11-13-15-16(17)14-12-10-8-6-4-2/h16H,3-15,17H2,1-2H3 |
| InChIKey | MHRITDAIAZETRS-UHFFFAOYSA-N |
| Mol Weight | 241.5 g/mol |
| Molecular Formula | C16H35N |
| Exact Mass | 241.27695 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ByRdnPyLCap |
|---|---|
| Name | Nonylamine, 1-heptyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.276950131 u |
| Formula | C16H35N |
| InChI | InChI=1S/C16H35N/c1-3-5-7-9-11-13-15-16(17)14-12-10-8-6-4-2/h16H,3-15,17H2,1-2H3 |
| InChIKey | MHRITDAIAZETRS-UHFFFAOYSA-N |
| Molecular Weight | 241.463 g/mol |
| SMILES | C(C(CCCCCCC)N)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890988 |