| SpectraBase Compound ID | Beh5aYXCW0b |
|---|---|
| InChI | InChI=1S/C9H18N2O/c1-3-4-9(12)11-6-5-10-8(2)7-11/h8,10H,3-7H2,1-2H3 |
| InChIKey | FDUVCRHFMMTGOH-UHFFFAOYSA-N |
| Mol Weight | 170.26 g/mol |
| Molecular Formula | C9H18N2O |
| Exact Mass | 170.141913 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8KOAVZhN10O |
|---|---|
| Name | 2-Methylpiperazine but |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.141913207 u |
| Formula | C9H18N2O |
| InChI | InChI=1S/C9H18N2O/c1-3-4-9(12)11-6-5-10-8(2)7-11/h8,10H,3-7H2,1-2H3 |
| InChIKey | FDUVCRHFMMTGOH-UHFFFAOYSA-N |
| Molecular Weight | 170.256 g/mol |
| SMILES | C1N(CCNC1C)C(CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.885233 |