| SpectraBase Spectrum ID |
IyPRoePZ99n |
| Name |
(E)-3-[1-(4-Chlorophenyl)ethoxy]-2-diazonio-1-ethoxy-3-keto-prop-1-en-1-olate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.056384603 u |
| Formula |
C13H13ClN2O4 |
| InChI |
InChI=1S/C13H13ClN2O4/c1-3-19-12(17)11(16-15)13(18)20-8(2)9-4-6-10(14)7-5-9/h4-8H,3H2,1-2H3 |
| InChIKey |
PJSUCJFJZOKAFX-UHFFFAOYSA-N |
| Molecular Weight |
296.710 g/mol |
| SMILES |
C(C(OC(C=1C=CC(=CC1)Cl)C)=O)(=[N+]=[N-])C(=O)OCC |
![(E)-3-[1-(4-chlorophenyl)ethoxy]-2-diazonio-1-ethoxy-3-keto-prop-1-en-1-olate](/api/spectrum/IyPRoePZ99n/structure.png?h=300&w=458 "(E)-3-[1-(4-chlorophenyl)ethoxy]-2-diazonio-1-ethoxy-3-keto-prop-1-en-1-olate")
