| SpectraBase Compound ID | KqbMC0cqZeX |
|---|---|
| InChI | InChI=1S/C9H17NO/c1-7-5-3-4-6-9(7)10-8(2)11/h7,9H,3-6H2,1-2H3,(H,10,11) |
| InChIKey | ILZIQTUVLRETQD-UHFFFAOYSA-N |
| Mol Weight | 155.24 g/mol |
| Molecular Formula | C9H17NO |
| Exact Mass | 155.131014 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AThAHdkaGoL |
|---|---|
| Name | 2-Methylcyclohexylamine, N-acetyl (stereoisomer 2) |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 155.131014170 u |
| Formula | C9H17NO |
| InChI | InChI=1S/C9H17NO/c1-7-5-3-4-6-9(7)10-8(2)11/h7,9H,3-6H2,1-2H3,(H,10,11) |
| InChIKey | ILZIQTUVLRETQD-UHFFFAOYSA-N |
| Molecular Weight | 155.241 g/mol |
| SMILES | C1(C(CCCC1)C)NC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.95756 |