SpectraBase Compound ID | EaJlY9KN27E |
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InChI | InChI=1S/C8H12O/c1-2-8(9)7-5-3-4-6-7/h2,5,8-9H,1,3-4,6H2 |
InChIKey | NYGRFASZFWUCAJ-UHFFFAOYSA-N |
Mol Weight | 124.18 g/mol |
Molecular Formula | C8H12O |
Exact Mass | 124.088815 g/mol |
SpectraBase Spectrum ID | e4Ts6HgIKr |
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Name | 1-(1-Cyclopentenyl)-2-propen-1-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 124.088815005 u |
Formula | C8H12O |
InChI | InChI=1S/C8H12O/c1-2-8(9)7-5-3-4-6-7/h2,5,8-9H,1,3-4,6H2 |
InChIKey | NYGRFASZFWUCAJ-UHFFFAOYSA-N |
Molecular Weight | 124.183 g/mol |
SMILES | C(C=C)(O)C1=CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.931786 |