SpectraBase Compound ID | EfbHo3R2pFl |
---|---|
InChI | InChI=1S/C10H21NO/c1-8(2)6-9(12)7-11-10(3,4)5/h8,11H,6-7H2,1-5H3 |
InChIKey | ZNRTXDWCHUQAOF-UHFFFAOYSA-N |
Mol Weight | 171.28 g/mol |
Molecular Formula | C10H21NO |
Exact Mass | 171.162314 g/mol |
SpectraBase Spectrum ID | LSse0FnPLh6 |
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Name | 1-(Tert-butylamino)-4-methylpentan-2-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 171.162314299 u |
Formula | C10H21NO |
InChI | InChI=1S/C10H21NO/c1-8(2)6-9(12)7-11-10(3,4)5/h8,11H,6-7H2,1-5H3 |
InChIKey | ZNRTXDWCHUQAOF-UHFFFAOYSA-N |
Molecular Weight | 171.284 g/mol |
SMILES | CC(C)(C)NCC(CC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959842 |