SpectraBase Compound ID | E2UgCR39BJP |
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InChI | InChI=1S/C11H21N/c1-9(10-7-8-10)12-11-5-3-2-4-6-11/h9-12H,2-8H2,1H3 |
InChIKey | PBAAKLGEAGWNDK-UHFFFAOYSA-N |
Mol Weight | 167.3 g/mol |
Molecular Formula | C11H21N |
Exact Mass | 167.1674 g/mol |
SpectraBase Spectrum ID | A9LMRSKEOqs |
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Name | N-(1-Cyclopropylethyl)cyclohexanamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 167.167399680 u |
Formula | C11H21N |
InChI | InChI=1S/C11H21N/c1-9(10-7-8-10)12-11-5-3-2-4-6-11/h9-12H,2-8H2,1H3 |
InChIKey | PBAAKLGEAGWNDK-UHFFFAOYSA-N |
Molecular Weight | 167.296 g/mol |
SMILES | C1(C(C)NC2CCCCC2)CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.893955 |