SpectraBase Compound ID | 9NrOs8EIBMW |
---|---|
InChI | InChI=1S/C11H11NO3/c1-8-7-15-11(13)12(8)9-3-5-10(14-2)6-4-9/h3-7H,1-2H3 |
InChIKey | MWGJDKFAIPKRQM-UHFFFAOYSA-N |
Mol Weight | 205.21 g/mol |
Molecular Formula | C11H11NO3 |
Exact Mass | 205.073893 g/mol |
SpectraBase Spectrum ID | Chyauhp1OeV |
---|---|
Name | N-(4-Anisyl)-4-methyl-4-oxazolin-2-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 205.073893215 u |
Formula | C11H11NO3 |
InChI | InChI=1S/C11H11NO3/c1-8-7-15-11(13)12(8)9-3-5-10(14-2)6-4-9/h3-7H,1-2H3 |
InChIKey | MWGJDKFAIPKRQM-UHFFFAOYSA-N |
Molecular Weight | 205.213 g/mol |
SMILES | C1(N(C(=CO1)C)C=1C=CC(=CC1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921571 |