| SpectraBase Compound ID | JSOXcq94QiM |
|---|---|
| InChI | InChI=1S/C17H18N2O4/c1-9(23-10(2)20)11-5-3-7-13-15(11)18-14-8-4-6-12(17(21)22)16(14)19-13/h3-10,17,20-22H,1-2H3 |
| InChIKey | CKGZWUZWVBWCHU-UHFFFAOYSA-N |
| Mol Weight | 314.34 g/mol |
| Molecular Formula | C17H18N2O4 |
| Exact Mass | 314.126657 g/mol |
Mass Spectrum (GC)
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DPZeCm6zbCQ |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C17H11N2O4D3 |
| InChI | InChI=1S/C17H18N2O4/c1-9(23-10(2)20)11-5-3-7-13-15(11)18-14-8-4-6-12(17(21)22)16(14)19-13/h3-10,17,20-22H,1-2H3 |
| InChIKey | CKGZWUZWVBWCHU-UHFFFAOYSA-N |
| Molecular Weight | 314.1262 |
| SMILES | OC(OC(c1cccc2nc3c(C(O)O)cccc3nc12)C)C |
| SPLASH | splash10-066r-2290000000-4884f5a22275a145a56b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |