| SpectraBase Compound ID | E2T7T5Wj3Ps |
|---|---|
| InChI | InChI=1S/C11H14INO/c12-11-3-1-2-10(8-11)9-13-4-6-14-7-5-13/h1-3,8H,4-7,9H2 |
| InChIKey | AXOCSNJJTDANIB-UHFFFAOYSA-N |
| Mol Weight | 303.14 g/mol |
| Molecular Formula | C11H14INO |
| Exact Mass | 303.012009 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DmBdSpCSmql |
|---|---|
| Name | 4-(3-Iodobenzyl)morpholine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.012009074 u |
| Formula | C11H14INO |
| InChI | InChI=1S/C11H14INO/c12-11-3-1-2-10(8-11)9-13-4-6-14-7-5-13/h1-3,8H,4-7,9H2 |
| InChIKey | AXOCSNJJTDANIB-UHFFFAOYSA-N |
| Molecular Weight | 303.143 g/mol |
| SMILES | C=1(CN2CCOCC2)C=C(C=CC1)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.811605 |