![1-[4-(Trifluoromethoxy)benzyl]piperazine, N-acetyl-](/api/spectrum/E9VUXxBpHtj/structure.png?h=300&w=458 "1-[4-(Trifluoromethoxy)benzyl]piperazine, N-acetyl-")
| SpectraBase Compound ID | 1pCn0Ml5vwJ |
|---|---|
| InChI | InChI=1S/C14H17F3N2O2/c1-11(20)19-8-6-18(7-9-19)10-12-2-4-13(5-3-12)21-14(15,16)17/h2-5H,6-10H2,1H3 |
| InChIKey | NIQFXVZXLBMCCN-UHFFFAOYSA-N |
| Mol Weight | 302.3 g/mol |
| Molecular Formula | C14H17F3N2O2 |
| Exact Mass | 302.124212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E9VUXxBpHtj |
|---|---|
| Name | 1-[4-(Trifluoromethoxy)benzyl]piperazine, N-acetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.124212282 u |
| Formula | C14H17F3N2O2 |
| InChI | InChI=1S/C14H17F3N2O2/c1-11(20)19-8-6-18(7-9-19)10-12-2-4-13(5-3-12)21-14(15,16)17/h2-5H,6-10H2,1H3 |
| InChIKey | NIQFXVZXLBMCCN-UHFFFAOYSA-N |
| Molecular Weight | 302.297 g/mol |
| SMILES | C(F)(F)(F)OC1=CC=C(C=C1)CN1CCN(CC1)C(=O)C |