| SpectraBase Compound ID | 9pIp6akQIIp |
|---|---|
| InChI | InChI=1S/C8H11F2NO/c1-6(12)11-3-2-7(5-11)4-8(7,9)10/h2-5H2,1H3 |
| InChIKey | PPPRORTYBWPNNM-UHFFFAOYSA-N |
| Mol Weight | 175.18 g/mol |
| Molecular Formula | C8H11F2NO |
| Exact Mass | 175.08087 g/mol |
| SpectraBase Spectrum ID | LMuB3kSm1f5 |
|---|---|
| Name | 1,1-Difluoro-5-azaspiro[2.4]heptane, N-acetyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.080870303 u |
| Formula | C8H11F2NO |
| InChI | InChI=1S/C8H11F2NO/c1-6(12)11-3-2-7(5-11)4-8(7,9)10/h2-5H2,1H3 |
| InChIKey | PPPRORTYBWPNNM-UHFFFAOYSA-N |
| Molecular Weight | 175.179 g/mol |
| SMILES | C1(F)(C2(CN(CC2)C(=O)C)C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94896 |