SpectraBase Compound ID | BWrROxJL959 |
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InChI | InChI=1S/C8H14/c1-3-8-6-4-5-7(8)2/h3-6H2,1-2H3 |
InChIKey | MMYZGQDXYZNAQW-UHFFFAOYSA-N |
Mol Weight | 110.2 g/mol |
Molecular Formula | C8H14 |
Exact Mass | 110.10955 g/mol |
SpectraBase Spectrum ID | AhH3LCeZTJK |
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Name | 1-Ethyl-2-methylcyclopentene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 110.109550451 u |
Formula | C8H14 |
InChI | InChI=1S/C8H14/c1-3-8-6-4-5-7(8)2/h3-6H2,1-2H3 |
InChIKey | MMYZGQDXYZNAQW-UHFFFAOYSA-N |
Molecular Weight | 110.200 g/mol |
SMILES | C1C(=C(CC1)C)CC |
Spectrum/Structure Validation Score (Raman) | 0.969303 |