| SpectraBase Compound ID | KNcR5YZr7CG |
|---|---|
| InChI | InChI=1S/C14H24INO2/c1-18-14(17)11-7-5-3-2-4-6-9-13(15)10-8-12-16/h13H,2-11H2,1H3 |
| InChIKey | YETRAZLYMJZNFK-UHFFFAOYSA-N |
| Mol Weight | 365.26 g/mol |
| Molecular Formula | C14H24INO2 |
| Exact Mass | 365.085174 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BjMuk98g83b |
|---|---|
| Name | 12-Cyano-10-iodo-lauric acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 365.085174015 u |
| Formula | C14H24INO2 |
| InChI | InChI=1S/C14H24INO2/c1-18-14(17)11-7-5-3-2-4-6-9-13(15)10-8-12-16/h13H,2-11H2,1H3 |
| InChIKey | YETRAZLYMJZNFK-UHFFFAOYSA-N |
| Molecular Weight | 365.255 g/mol |
| SMILES | C(CCCCCCCCC(CCC#N)I)(=O)OC |