SpectraBase Compound ID | B02FGG3Ld6y |
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InChI | InChI=1S/C12H16O/c1-2-12(9-6-10-13-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3 |
InChIKey | AUMNFOOKUDHWSX-UHFFFAOYSA-N |
Mol Weight | 176.26 g/mol |
Molecular Formula | C12H16O |
Exact Mass | 176.120115 g/mol |
SpectraBase Spectrum ID | K1JBDiUfRyJ |
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Name | 2-Ethyl-2-phenyltetrahydrofuran |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 176.120115134 u |
Formula | C12H16O |
InChI | InChI=1S/C12H16O/c1-2-12(9-6-10-13-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3 |
InChIKey | AUMNFOOKUDHWSX-UHFFFAOYSA-N |
Molecular Weight | 176.259 g/mol |
SMILES | C1(OCCC1)(C=1C=CC=CC1)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.840701 |