SpectraBase Compound ID | 1204JpjT4nT |
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InChI | InChI=1S/C9H18N2O/c1-5-11(6-2)9(8-12)7-10(3)4/h7-8H,5-6H2,1-4H3/b9-7+ |
InChIKey | YWPAMAUHYJKXQO-VQHVLOKHSA-N |
Mol Weight | 170.26 g/mol |
Molecular Formula | C9H18N2O |
Exact Mass | 170.141913 g/mol |
SpectraBase Spectrum ID | 9OplhvtrNBf |
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Name | 2-Propenal, 2-(diethylamino)-3-(dimethylamino)- |
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/c1-5-11(6-2)9(8-12)7-10(3)4/h7-8H,5-6H2,1-4H3/b9-7+ |
InChIKey | YWPAMAUHYJKXQO-VQHVLOKHSA-N |
Molecular Weight | 170.256 g/mol |
SMILES | CN(\C=C/(N(CC)CC)C=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.980197 |