![7-Propanoyl-7-azabicylo[4.1.0]heptane](/api/spectrum/NugqMilWPt/structure.png?h=300&w=458 "7-Propanoyl-7-azabicylo[4.1.0]heptane")
| SpectraBase Compound ID | 69hcDYo1o0t |
|---|---|
| InChI | InChI=1S/C9H15NO/c1-2-9(11)10-7-5-3-4-6-8(7)10/h7-8H,2-6H2,1H3 |
| InChIKey | HBKYZIBWGJDKRU-UHFFFAOYSA-N |
| Mol Weight | 153.22 g/mol |
| Molecular Formula | C9H15NO |
| Exact Mass | 153.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | NugqMilWPt |
|---|---|
| Name | 7-Propanoyl-7-azabicylo[4.1.0]heptane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 153.115364106 u |
| Formula | C9H15NO |
| InChI | InChI=1S/C9H15NO/c1-2-9(11)10-7-5-3-4-6-8(7)10/h7-8H,2-6H2,1H3 |
| InChIKey | HBKYZIBWGJDKRU-UHFFFAOYSA-N |
| Molecular Weight | 153.225 g/mol |
| SMILES | C12N(C1CCCC2)C(=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930485 |