![1-{alpha-[p-(1,3-dithiolan-2-yl)phenoxy]-m-toluoyl}-4-isopropylsemicarbazide](/api/spectrum/10GRxzuiaUZ/structure.png?h=300&w=458 "1-{alpha-[p-(1,3-dithiolan-2-yl)phenoxy]-m-toluoyl}-4-isopropylsemicarbazide")
| SpectraBase Compound ID | 7FuR18dAVXQ |
|---|---|
| InChI | InChI=1S/C21H25N3O3S2/c1-14(2)22-21(26)24-23-19(25)17-5-3-4-15(12-17)13-27-18-8-6-16(7-9-18)20-28-10-11-29-20/h3-9,12,14,20H,10-11,13H2,1-2H3,(H,23,25)(H2,22,24,26) |
| InChIKey | RDWIWRIUEFQNHC-UHFFFAOYSA-N |
| Mol Weight | 431.57 g/mol |
| Molecular Formula | C21H25N3O3S2 |
| Exact Mass | 431.133734 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 10GRxzuiaUZ |
|---|---|
| Name | 1-{alpha-[p-(1,3-dithiolan-2-yl)phenoxy]-m-toluoyl}-4-isopropylsemicarbazide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H25N3O3S2 |
| InChI | InChI=1S/C21H25N3O3S2/c1-14(2)22-21(26)24-23-19(25)17-5-3-4-15(12-17)13-27-18-8-6-16(7-9-18)20-28-10-11-29-20/h3-9,12,14,20H,10-11,13H2,1-2H3,(H,23,25)(H2,22,24,26) |
| InChIKey | RDWIWRIUEFQNHC-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56239M |
| Solvent | DMSO-d6 |