SpectraBase Compound ID | D6bk3DKjAqK |
---|---|
InChI | InChI=1S/C11H11NO/c1-11(7-8-12-9-13-11)10-5-3-2-4-6-10/h2-9H,1H3 |
InChIKey | KUHJEBQHWHSQKL-UHFFFAOYSA-N |
Mol Weight | 173.21 g/mol |
Molecular Formula | C11H11NO |
Exact Mass | 173.084064 g/mol |
SpectraBase Spectrum ID | 7rHQI6oVsLM |
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Name | 6-Methyl-6-phenyl-6H-1,3-oxazine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 173.084063977 u |
Formula | C11H11NO |
InChI | InChI=1S/C11H11NO/c1-11(7-8-12-9-13-11)10-5-3-2-4-6-10/h2-9H,1H3 |
InChIKey | KUHJEBQHWHSQKL-UHFFFAOYSA-N |
Molecular Weight | 173.215 g/mol |
SMILES | CC1(OC=NC=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.929675 |