![(Benzo[1,3]dioxol-5-ylmethyl)(3,4-difluorobenzyl)amine](/api/spectrum/8P8sKH7Ramd/structure.png?h=300&w=458 "(Benzo[1,3]dioxol-5-ylmethyl)(3,4-difluorobenzyl)amine")
| SpectraBase Compound ID | 8x4jcP6Y0o7 |
|---|---|
| InChI | InChI=1S/C15H13F2NO2/c16-12-3-1-10(5-13(12)17)7-18-8-11-2-4-14-15(6-11)20-9-19-14/h1-6,18H,7-9H2 |
| InChIKey | JLEOBZUWXJDTQC-UHFFFAOYSA-N |
| Mol Weight | 277.27 g/mol |
| Molecular Formula | C15H13F2NO2 |
| Exact Mass | 277.091435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8P8sKH7Ramd |
|---|---|
| Name | (Benzo[1,3]dioxol-5-ylmethyl)(3,4-difluorobenzyl)amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.091434987 u |
| Formula | C15H13F2NO2 |
| InChI | InChI=1S/C15H13F2NO2/c16-12-3-1-10(5-13(12)17)7-18-8-11-2-4-14-15(6-11)20-9-19-14/h1-6,18H,7-9H2 |
| InChIKey | JLEOBZUWXJDTQC-UHFFFAOYSA-N |
| Molecular Weight | 277.271 g/mol |
| SMILES | C1OC2=CC=C(CNCC3=CC(=C(C=C3)F)F)C=C2O1 |