SpectraBase Compound ID | K04ymPENx7S |
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InChI | InChI=1S/C10H14O/c1-3-9-4-5-10(7-9)6-8(2)11/h3-5,9-10H,1,6-7H2,2H3 |
InChIKey | SEOLTBAYUUIMFV-UHFFFAOYSA-N |
Mol Weight | 150.22 g/mol |
Molecular Formula | C10H14O |
Exact Mass | 150.104465 g/mol |
SpectraBase Spectrum ID | F20zet6K8g8 |
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Name | 1-(Acetylmethyl)-3-ethenyl-4-cyclopentene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 150.104465070 u |
Formula | C10H14O |
InChI | InChI=1S/C10H14O/c1-3-9-4-5-10(7-9)6-8(2)11/h3-5,9-10H,1,6-7H2,2H3 |
InChIKey | SEOLTBAYUUIMFV-UHFFFAOYSA-N |
Molecular Weight | 150.221 g/mol |
SMILES | C1=CC(C=C)CC1CC(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97586 |