SpectraBase Compound ID | 2Qkkw1MGG7u |
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InChI | InChI=1S/C27H41N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26(31)28-25-23-27(32)30(29-25)24-20-17-16-18-21-24/h9-10,16-18,20-21H,2-8,11-15,19,22-23H2,1H3,(H,28,29,31) |
InChIKey | KIZIRRWZTGNUCT-UHFFFAOYSA-N |
Mol Weight | 439.6 g/mol |
Molecular Formula | C27H41N3O2 |
Exact Mass | 439.319878 g/mol |
SpectraBase Spectrum ID | 8p0O6gSM5pC |
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Name | N-(4,5-Dihydro-5-oxo-1-phenyl-1H-pyrazol-3-yl)-9-octadecenamide |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 401315 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C27H41N3O2 |
InChI | InChI=1S/C27H41N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26(31)28-25-23-27(32)30(29-25)24-20-17-16-18-21-24/h9-10,16-18,20-21H,2-8,11-15,19,22-23H2,1H3,(H,28,29,31) |
InChIKey | KIZIRRWZTGNUCT-UHFFFAOYSA-N |
Molecular Weight | 439.644 g/mol |
Observed nucleus | 1H |
Purity | 75% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_014000 |