| SpectraBase Compound ID | BaPIrGgTkXu |
|---|---|
| InChI | InChI=1S/C11H13N/c1-2-4-11-10(3-1)9-5-7-12(11)8-6-9/h1-4,9H,5-8H2 |
| InChIKey | RNFRFPSSWGWDKI-UHFFFAOYSA-N |
| Mol Weight | 159.23 g/mol |
| Molecular Formula | C11H13N |
| Exact Mass | 159.104799 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GwEp6ThNCiZ |
|---|---|
| Name | 2H-1,4-Ethanoquinoline, 3,4-dihydro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.104799423 u |
| Formula | C11H13N |
| InChI | InChI=1S/C11H13N/c1-2-4-11-10(3-1)9-5-7-12(11)8-6-9/h1-4,9H,5-8H2 |
| InChIKey | RNFRFPSSWGWDKI-UHFFFAOYSA-N |
| Molecular Weight | 159.232 g/mol |
| SMILES | C12=C(C3CCN2CC3)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944624 |