SpectraBase Compound ID | KASetvaZ2wk |
---|---|
InChI | InChI=1S/C10H16O/c1-2-3-4-6-9-7-5-8-10(9)11/h6H,2-5,7-8H2,1H3/b9-6+ |
InChIKey | YZKUNNFZLUCEET-RMKNXTFCSA-N |
Mol Weight | 152.24 g/mol |
Molecular Formula | C10H16O |
Exact Mass | 152.120115 g/mol |
SpectraBase Spectrum ID | oy6ONq4jtz |
---|---|
Name | (2E)-2-Pentylidenecyclopentanone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 152.120115134 u |
Formula | C10H16O |
InChI | InChI=1S/C10H16O/c1-2-3-4-6-9-7-5-8-10(9)11/h6H,2-5,7-8H2,1H3/b9-6+ |
InChIKey | YZKUNNFZLUCEET-RMKNXTFCSA-N |
Molecular Weight | 152.237 g/mol |
SMILES | C1(\C(CCC1)=C\CCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.8439 |