| SpectraBase Compound ID | GrkSndWjWK1 |
|---|---|
| InChI | InChI=1S/C15H18F3NO3/c1-10(2)9-22-13(20)8-19(3)14(21)11-4-6-12(7-5-11)15(16,17)18/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | UIRNOCRCQIEJJH-UHFFFAOYSA-N |
| Mol Weight | 317.31 g/mol |
| Molecular Formula | C15H18F3NO3 |
| Exact Mass | 317.123878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | lW1LPFd4HY |
|---|---|
| Name | Sarcosine, N-(4-trifluoromethylbenzoyl)-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.123877930 u |
| Formula | C15H18F3NO3 |
| InChI | InChI=1S/C15H18F3NO3/c1-10(2)9-22-13(20)8-19(3)14(21)11-4-6-12(7-5-11)15(16,17)18/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | UIRNOCRCQIEJJH-UHFFFAOYSA-N |
| Molecular Weight | 317.308 g/mol |
| SMILES | C(CN(C(=O)C=1C=CC(C(F)(F)F)=CC1)C)(OCC(C)C)=O |