| SpectraBase Spectrum ID |
IENsOs62Xk7 |
| Name |
1,3-Dioxan-2,2-dimethyl-4,5,6-trion-5-(4-bromophenyl)-methylhydrazone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.005869903 u |
| Formula |
C13H13BrN2O4 |
| InChI |
InChI=1S/C13H13BrN2O4/c1-13(2)19-11(17)10(12(18)20-13)15-16(3)9-6-4-8(14)5-7-9/h4-7H,1-3H3 |
| InChIKey |
BQQRENPMAXTAHL-UHFFFAOYSA-N |
| Molecular Weight |
341.161 g/mol |
| SMILES |
C1(=CC=C(C=C1)Br)N(C)N=C1C(OC(OC1=O)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891817 |
