| SpectraBase Compound ID | E4sH9yVc0OI |
|---|---|
| InChI | InChI=1S/C17H22N2O4S/c1-4-7-14(17(20)21)18-24(22,23)16-11-6-8-12-13(16)9-5-10-15(12)19(2)3/h5-6,8-11,14,18H,4,7H2,1-3H3,(H,20,21) |
| InChIKey | XRCZZVVWVGSUGJ-UHFFFAOYSA-N |
| Mol Weight | 350.43 g/mol |
| Molecular Formula | C17H22N2O4S |
| Exact Mass | 350.130028 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DNChqpaFRCY |
|---|---|
| Name | Dansyl-L-norvaline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.130028366 u |
| Formula | C17H22N2O4S |
| InChI | InChI=1S/C17H22N2O4S/c1-4-7-14(17(20)21)18-24(22,23)16-11-6-8-12-13(16)9-5-10-15(12)19(2)3/h5-6,8-11,14,18H,4,7H2,1-3H3,(H,20,21) |
| InChIKey | XRCZZVVWVGSUGJ-UHFFFAOYSA-N |
| Molecular Weight | 350.433 g/mol |
| SMILES | C1=2C(=C(C=CC2)N(C)C)C=CC=C1S(=O)(=O)NC(CCC)C(=O)O |