SpectraBase Compound ID | FYjqqcrotZN |
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InChI | InChI=1S/C8H15NO2/c1-7(2)8(11)9-5-3-4-6-10/h10H,1,3-6H2,2H3,(H,9,11) |
InChIKey | TVDRFWWLJYRVMV-UHFFFAOYSA-N |
Mol Weight | 157.21 g/mol |
Molecular Formula | C8H15NO2 |
Exact Mass | 157.110279 g/mol |
SpectraBase Spectrum ID | VZFok3zvlR |
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Name | N-(4-Hydroxybutyl)-2-methyl-2-propenamide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 157.110278725 u |
Formula | C8H15NO2 |
InChI | InChI=1S/C8H15NO2/c1-7(2)8(11)9-5-3-4-6-10/h10H,1,3-6H2,2H3,(H,9,11) |
InChIKey | TVDRFWWLJYRVMV-UHFFFAOYSA-N |
Molecular Weight | 157.213 g/mol |
SMILES | C(CCCO)NC(C(=C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944468 |