![N-{4-[p-(diethylamino)phenylimino]-5-oxo-1-phenyl-2-pyrazolin-3-yl}hexadecanamide](/api/spectrum/7C0dRrWTw6T/structure.png?h=300&w=458 "N-{4-[p-(diethylamino)phenylimino]-5-oxo-1-phenyl-2-pyrazolin-3-yl}hexadecanamide")
| SpectraBase Compound ID | 8qfpJLPbLyT |
|---|---|
| InChI | InChI=1S/C35H51N5O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-21-24-32(41)37-34-33(35(42)40(38-34)31-22-19-18-20-23-31)36-29-25-27-30(28-26-29)39(5-2)6-3/h18-20,22-23,25-28H,4-17,21,24H2,1-3H3,(H,37,38,41)/b36-33+ |
| InChIKey | OLGZHJSWYSFCME-PKUSAGTQSA-N |
| Mol Weight | 573.8 g/mol |
| Molecular Formula | C35H51N5O2 |
| Exact Mass | 573.404276 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7C0dRrWTw6T |
|---|---|
| Name | N-{4-[p-(Diethylamino)phenylimino]-5-oxo-1-phenyl-2-pyrazolin-3-yl}hexadecanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 573.404275900 u |
| Formula | C35H51N5O2 |
| InChI | InChI=1S/C35H51N5O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-21-24-32(41)37-34-33(35(42)40(38-34)31-22-19-18-20-23-31)36-29-25-27-30(28-26-29)39(5-2)6-3/h18-20,22-23,25-28H,4-17,21,24H2,1-3H3,(H,37,38,41)/b36-33+ |
| InChIKey | OLGZHJSWYSFCME-PKUSAGTQSA-N |
| Molecular Weight | 573.826 g/mol |
| SMILES | N(C=1\C(C(N(N1)C1=CC=CC=C1)=O)=N/C=1C=CC(=CC1)N(CC)CC)C(CCCCCCCCCCCCCCC)=O |