SpectraBase Compound ID | 8k7mESKDgJD |
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InChI | InChI=1S/C10H15NO/c1-3-4-5-8-11-9(2)6-7-10(11)12/h9H,3,6-8H2,1-2H3 |
InChIKey | MJHGETLEBHLLCL-UHFFFAOYSA-N |
Mol Weight | 165.24 g/mol |
Molecular Formula | C10H15NO |
Exact Mass | 165.115364 g/mol |
SpectraBase Spectrum ID | LXFdzd5Nq78 |
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Name | 5-Methyl-1-(2-pentynyl)-2-pyrrolidinone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 165.115364106 u |
Formula | C10H15NO |
InChI | InChI=1S/C10H15NO/c1-3-4-5-8-11-9(2)6-7-10(11)12/h9H,3,6-8H2,1-2H3 |
InChIKey | MJHGETLEBHLLCL-UHFFFAOYSA-N |
Molecular Weight | 165.236 g/mol |
SMILES | C1(N(C(CC1)C)CC#CCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975194 |