![2-(hexadecylsulfonyl)-3-[1-methyl-6-nitro-2-phenyl-4(1H) quinolylidene] carbazic acid, ethyl ester](/api/spectrum/Dvt2dV1j4yE/structure.png?h=300&w=458 "2-(hexadecylsulfonyl)-3-[1-methyl-6-nitro-2-phenyl-4(1H) quinolylidene] carbazic acid, ethyl ester")
| SpectraBase Compound ID | K7GyuI8I9YR |
|---|---|
| InChI | InChI=1S/C35H50N4O6S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21-26-46(43,44)38(35(40)45-5-2)36-32-28-34(29-22-19-18-20-23-29)37(3)33-25-24-30(39(41)42)27-31(32)33/h18-20,22-25,27-28H,4-17,21,26H2,1-3H3/b36-32+ |
| InChIKey | OTKPXQIVNDKLLG-WIKZRCHHSA-N |
| Mol Weight | 654.9 g/mol |
| Molecular Formula | C35H50N4O6S |
| Exact Mass | 654.345107 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dvt2dV1j4yE |
|---|---|
| Name | 2-(hexadecylsulfonyl)-3-[1-methyl-6-nitro-2-phenyl-4(1H) quinolylidene] carbazic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H50N4O6S |
| InChI | InChI=1S/C35H50N4O6S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21-26-46(43,44)38(35(40)45-5-2)36-32-28-34(29-22-19-18-20-23-29)37(3)33-25-24-30(39(41)42)27-31(32)33/h18-20,22-25,27-28H,4-17,21,26H2,1-3H3/b36-32+ |
| InChIKey | OTKPXQIVNDKLLG-WIKZRCHHSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 39454M |
| Solvent | CDCl3 |