SpectraBase Compound ID | 2GhyRLN8ixN |
---|---|
InChI | InChI=1S/C7H11NO/c1-5-7(2,3)4-6(9)8-5/h1,4H2,2-3H3,(H,8,9) |
InChIKey | DXAWLNRCYYPHTI-UHFFFAOYSA-N |
Mol Weight | 125.17 g/mol |
Molecular Formula | C7H11NO |
Exact Mass | 125.084064 g/mol |
SpectraBase Spectrum ID | 3bKDFHpwLFS |
---|---|
Name | 2-Pyrrolidinone, 4,4-dimethyl-5-methylidene- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 125.084063977 u |
Formula | C7H11NO |
InChI | InChI=1S/C7H11NO/c1-5-7(2,3)4-6(9)8-5/h1,4H2,2-3H3,(H,8,9) |
InChIKey | DXAWLNRCYYPHTI-UHFFFAOYSA-N |
Molecular Weight | 125.171 g/mol |
SMILES | C=C1NC(=O)CC1(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.842349 |