SpectraBase Compound ID | EFh4Icz9csR |
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InChI | InChI=1S/C8H9NO/c1-2-6-9-7-4-3-5-8(9)10/h2-7H,1H3/b6-2+ |
InChIKey | CXYVQZUTPZAMFP-QHHAFSJGSA-N |
Mol Weight | 135.17 g/mol |
Molecular Formula | C8H9NO |
Exact Mass | 135.068414 g/mol |
SpectraBase Spectrum ID | 1mGvKK4DIcE |
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Name | 1-[(E)-Prop-1-enyl]-2-pyridinone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 135.068413913 u |
Formula | C8H9NO |
InChI | InChI=1S/C8H9NO/c1-2-6-9-7-4-3-5-8(9)10/h2-7H,1H3/b6-2+ |
InChIKey | CXYVQZUTPZAMFP-QHHAFSJGSA-N |
Molecular Weight | 135.166 g/mol |
SMILES | C1(N(C=CC=C1)\C=C\C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966312 |