SpectraBase Compound ID | GTZqDh6bidN |
---|---|
InChI | InChI=1S/C6H12O/c1-2-6-4-3-5-7-6/h6H,2-5H2,1H3/t6-/m0/s1 |
InChIKey | IHMXVSZXHFTOFN-LURJTMIESA-N |
Mol Weight | 100.16 g/mol |
Molecular Formula | C6H12O |
Exact Mass | 100.088815 g/mol |
SpectraBase Spectrum ID | 8phHt0IFF4p |
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Name | (2S)-2-Ethyltetrahydrofuran |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 100.088815005 u |
Formula | C6H12O |
InChI | InChI=1S/C6H12O/c1-2-6-4-3-5-7-6/h6H,2-5H2,1H3/t6-/m0/s1 |
InChIKey | IHMXVSZXHFTOFN-LURJTMIESA-N |
Molecular Weight | 100.161 g/mol |
SMILES | [C@@]1(OCCC1)(CC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97001 |