| SpectraBase Compound ID | 4GxTv6eBWbp |
|---|---|
| InChI | InChI=1S/C11H22INO/c1-3-13(4-2)11(14)9-7-5-6-8-10-12/h3-10H2,1-2H3 |
| InChIKey | NGOBKOYCUWUTBI-UHFFFAOYSA-N |
| Mol Weight | 311.21 g/mol |
| Molecular Formula | C11H22INO |
| Exact Mass | 311.074609 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DVIkoxMClrd |
|---|---|
| Name | N,N-Diethyl 7-iodoheptanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.074609331 u |
| Formula | C11H22INO |
| InChI | InChI=1S/C11H22INO/c1-3-13(4-2)11(14)9-7-5-6-8-10-12/h3-10H2,1-2H3 |
| InChIKey | NGOBKOYCUWUTBI-UHFFFAOYSA-N |
| Molecular Weight | 311.207 g/mol |
| SMILES | C(N(CC)CC)(=O)CCCCCCI |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.883665 |