| SpectraBase Compound ID | 1HOmM26SZ89 |
|---|---|
| InChI | InChI=1S/C8H16N2/c1-3-4-7-10-8(2)5-6-9-10/h6,8H,3-5,7H2,1-2H3 |
| InChIKey | IPKPLDIJSVOODS-UHFFFAOYSA-N |
| Mol Weight | 140.23 g/mol |
| Molecular Formula | C8H16N2 |
| Exact Mass | 140.131349 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4QgO0tBm9kB |
|---|---|
| Name | 2-Pyrazoline, 1-butyl-5-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.131348523 u |
| Formula | C8H16N2 |
| InChI | InChI=1S/C8H16N2/c1-3-4-7-10-8(2)5-6-9-10/h6,8H,3-5,7H2,1-2H3 |
| InChIKey | IPKPLDIJSVOODS-UHFFFAOYSA-N |
| Molecular Weight | 140.230 g/mol |
| SMILES | C(CN1C(C)CC=N1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937514 |