SpectraBase Compound ID | AFfpYBb7GzX |
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InChI | InChI=1S/C9H17NO2/c1-9(2,3)8(11)10-4-6-12-7-5-10/h4-7H2,1-3H3 |
InChIKey | ZNYMSOJUAJANBK-UHFFFAOYSA-N |
Mol Weight | 171.24 g/mol |
Molecular Formula | C9H17NO2 |
Exact Mass | 171.125929 g/mol |
SpectraBase Spectrum ID | 14gv7ExqnAU |
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Name | 2,2-Dimethylpropionic acid, morpholide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 171.125928789 u |
Formula | C9H17NO2 |
InChI | InChI=1S/C9H17NO2/c1-9(2,3)8(11)10-4-6-12-7-5-10/h4-7H2,1-3H3 |
InChIKey | ZNYMSOJUAJANBK-UHFFFAOYSA-N |
Molecular Weight | 171.240 g/mol |
SMILES | C(C(=O)N1CCOCC1)(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975491 |