SpectraBase Compound ID | KYcqz804gKb |
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InChI | InChI=1S/C15H29NO/c1-3-4-5-6-7-8-9-10-13-16-14(2)11-12-15(16)17/h14H,3-13H2,1-2H3 |
InChIKey | XNNZELUYRQQXRD-UHFFFAOYSA-N |
Mol Weight | 239.4 g/mol |
Molecular Formula | C15H29NO |
Exact Mass | 239.224915 g/mol |
SpectraBase Spectrum ID | 7CwMMrZ3YDA |
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Name | N-Decyl-5-methyl-2-pyrrolidone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 239.224914557 u |
Formula | C15H29NO |
InChI | InChI=1S/C15H29NO/c1-3-4-5-6-7-8-9-10-13-16-14(2)11-12-15(16)17/h14H,3-13H2,1-2H3 |
InChIKey | XNNZELUYRQQXRD-UHFFFAOYSA-N |
Molecular Weight | 239.403 g/mol |
SMILES | C1(N(C(CC1)C)CCCCCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.895341 |