SpectraBase Compound ID | EL6eDq5GqyX |
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InChI | InChI=1S/C8H16O3/c1-3-9-8(10-4-2)5-7-6-11-7/h7-8H,3-6H2,1-2H3/t7-/m0/s1 |
InChIKey | GZGXWSZGKAWATN-ZETCQYMHSA-N |
Mol Weight | 160.21 g/mol |
Molecular Formula | C8H16O3 |
Exact Mass | 160.109944 g/mol |
SpectraBase Spectrum ID | 33chw1gw5tG |
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Name | (2S)-2-(2,2-Diethoxyethyl)oxirane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 160.109944372 u |
Formula | C8H16O3 |
InChI | InChI=1S/C8H16O3/c1-3-9-8(10-4-2)5-7-6-11-7/h7-8H,3-6H2,1-2H3/t7-/m0/s1 |
InChIKey | GZGXWSZGKAWATN-ZETCQYMHSA-N |
Molecular Weight | 160.213 g/mol |
SMILES | [C@@]1(OC1)(CC(OCC)OCC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981733 |