SpectraBase Compound ID | 7RtyQgFoCoe |
---|---|
InChI | InChI=1S/C12H19NO2/c1-12(2)8-10(7-11(14)9-12)13-3-5-15-6-4-13/h7H,3-6,8-9H2,1-2H3 |
InChIKey | AZJFAQDAOWAUAN-UHFFFAOYSA-N |
Mol Weight | 209.29 g/mol |
Molecular Formula | C12H19NO2 |
Exact Mass | 209.141579 g/mol |
SpectraBase Spectrum ID | BcAsvKaTVps |
---|---|
Name | 5,5-Dimethyl-3-morpholino-2-cyclohexen-1-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 209.141578854 u |
Formula | C12H19NO2 |
InChI | InChI=1S/C12H19NO2/c1-12(2)8-10(7-11(14)9-12)13-3-5-15-6-4-13/h7H,3-6,8-9H2,1-2H3 |
InChIKey | AZJFAQDAOWAUAN-UHFFFAOYSA-N |
Molecular Weight | 209.289 g/mol |
SMILES | C1=C(CC(CC1=O)(C)C)N1CCOCC1 |
Spectrum/Structure Validation Score (Raman) | 0.989968 |