SpectraBase Compound ID | 7nhzeUuMzT3 |
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InChI | InChI=1S/C7H13FO/c1-6(4-8)7(2)5-9-3/h4-5H2,1-3H3/b7-6+ |
InChIKey | YXPUEGPUZCFJOJ-VOTSOKGWSA-N |
Mol Weight | 132.18 g/mol |
Molecular Formula | C7H13FO |
Exact Mass | 132.095043 g/mol |
SpectraBase Spectrum ID | EU97qMjG5e1 |
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Name | 1-Fluoro-2,3-dimethyl-4-methoxy-2-butene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 132.095043201 u |
Formula | C7H13FO |
InChI | InChI=1S/C7H13FO/c1-6(4-8)7(2)5-9-3/h4-5H2,1-3H3/b7-6+ |
InChIKey | YXPUEGPUZCFJOJ-VOTSOKGWSA-N |
Molecular Weight | 132.178 g/mol |
SMILES | C(\C(=C\(CF)C)C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.950251 |