SpectraBase Compound ID | 6B6iptwNEHs |
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InChI | InChI=1S/C9H17NO/c1-5-8(4)9(11)10(6-2)7-3/h5H,6-7H2,1-4H3/b8-5+ |
InChIKey | FKTDBDLCSXPFJU-VMPITWQZSA-N |
Mol Weight | 155.24 g/mol |
Molecular Formula | C9H17NO |
Exact Mass | 155.131014 g/mol |
SpectraBase Spectrum ID | 5Cz9yYjNaPQ |
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Name | 2-Butenamide, N,N-diethyl-2-methyl-, (E)- |
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/c1-5-8(4)9(11)10(6-2)7-3/h5H,6-7H2,1-4H3/b8-5+ |
InChIKey | FKTDBDLCSXPFJU-VMPITWQZSA-N |
Molecular Weight | 155.241 g/mol |
SMILES | CCN(CC)C(\C(C)=C\C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.834243 |