SpectraBase Compound ID | HyS0eUM1wEg |
---|---|
InChI | InChI=1S/C14H18O/c1-10-8-11(2)14(12(3)9-10)13-6-4-5-7-15-13/h5,7-9,13H,4,6H2,1-3H3 |
InChIKey | RMBKUACDIXHZTA-UHFFFAOYSA-N |
Mol Weight | 202.3 g/mol |
Molecular Formula | C14H18O |
Exact Mass | 202.135765 g/mol |
SpectraBase Spectrum ID | UUOmblQNbG |
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Name | 2-Mesityl-3,4-dihydro-2H-pyran |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 202.135765199 u |
Formula | C14H18O |
InChI | InChI=1S/C14H18O/c1-10-8-11(2)14(12(3)9-10)13-6-4-5-7-15-13/h5,7-9,13H,4,6H2,1-3H3 |
InChIKey | RMBKUACDIXHZTA-UHFFFAOYSA-N |
Molecular Weight | 202.297 g/mol |
SMILES | C1(CCC=CO1)C=1C(C)=CC(C)=CC1C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94881 |