| SpectraBase Compound ID | FuHfiq0BTPy |
|---|---|
| InChI | InChI=1S/C10H20N2/c1-2-3-4-5-6-9-12-10-7-8-11-12/h8H,2-7,9-10H2,1H3 |
| InChIKey | MDMHVCOCBFESHD-UHFFFAOYSA-N |
| Mol Weight | 168.28 g/mol |
| Molecular Formula | C10H20N2 |
| Exact Mass | 168.162649 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8U0ijPEQASH |
|---|---|
| Name | 1-Heptyl-4,5-dihydropyrazole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.162648652 u |
| Formula | C10H20N2 |
| InChI | InChI=1S/C10H20N2/c1-2-3-4-5-6-9-12-10-7-8-11-12/h8H,2-7,9-10H2,1H3 |
| InChIKey | MDMHVCOCBFESHD-UHFFFAOYSA-N |
| Molecular Weight | 168.284 g/mol |
| SMILES | C1N(N=CC1)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.842835 |