![(E)-5-(Hept-1-en-1-yl]-3,4-dihydro-2H-pyrole](/api/spectrum/Hs72nmgTVkI/structure.png?h=300&w=458 "(E)-5-(Hept-1-en-1-yl]-3,4-dihydro-2H-pyrole")
| SpectraBase Compound ID | 2xZb5TBhfe |
|---|---|
| InChI | InChI=1S/C11H19N/c1-2-3-4-5-6-8-11-9-7-10-12-11/h6,8H,2-5,7,9-10H2,1H3/b8-6+ |
| InChIKey | LEHKDAQGFWHPRZ-SOFGYWHQSA-N |
| Mol Weight | 165.28 g/mol |
| Molecular Formula | C11H19N |
| Exact Mass | 165.15175 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Hs72nmgTVkI |
|---|---|
| Name | (E)-5-(Hept-1-en-1-yl]-3,4-dihydro-2H-pyrole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.151749616 u |
| Formula | C11H19N |
| InChI | InChI=1S/C11H19N/c1-2-3-4-5-6-8-11-9-7-10-12-11/h6,8H,2-5,7,9-10H2,1H3/b8-6+ |
| InChIKey | LEHKDAQGFWHPRZ-SOFGYWHQSA-N |
| Molecular Weight | 165.280 g/mol |
| SMILES | C(CCC\C=C\C=1CCCN1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943239 |