| SpectraBase Spectrum ID |
10tvECHoLWQ |
| Name |
Dimethyl 8,9,18,19-tetrahydro-7H,217H-dibenzo[F,o][14.20,8]dioxazacyclohexadecine-6,10-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
437.183837587 u |
| Formula |
C25H27NO6 |
| InChI |
InChI=1S/C25H27NO6/c1-29-24(27)20-14-18-8-3-5-10-22(18)31-12-7-13-32-23-11-6-4-9-19(23)15-21(17-26-16-20)25(28)30-2/h3-6,8-11,14-15,26H,7,12-13,16-17H2,1-2H3/b20-14+,21-15+ |
| InChIKey |
UQRPIHMAHAVHGF-OZNQKUEASA-N |
| Molecular Weight |
437.492 g/mol |
| SMILES |
C=12\C=C/(CNC\C(=C/C3=C(OCCCOC2=CC=CC1)C=CC=C3)C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89045 |
![Dimethyl 8,9,18,19-tetrahydro-7H,217H-dibenzo[f,o][14.20,8]dioxazacyclohexadecine-6,10-dicarboxylate](/api/spectrum/10tvECHoLWQ/structure.png?h=300&w=458 "Dimethyl 8,9,18,19-tetrahydro-7H,217H-dibenzo[f,o][14.20,8]dioxazacyclohexadecine-6,10-dicarboxylate")
