| SpectraBase Spectrum ID |
812sn4Bx9h7 |
| Name |
1,4,10,13-Tetraoxa-7,16-diaza-cyclooctadecane-7,16-dicarboxylic acid diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
406.231516055 u |
| Formula |
C18H34N2O8 |
| InChI |
InChI=1S/C18H34N2O8/c1-3-27-17(21)19-5-9-23-13-15-25-11-7-20(18(22)28-4-2)8-12-26-16-14-24-10-6-19/h3-16H2,1-2H3 |
| InChIKey |
NWYYUJUCCPVGOM-UHFFFAOYSA-N |
| Molecular Weight |
406.476 g/mol |
| SMILES |
C(N1CCOCCOCCN(C(=O)OCC)CCOCCOCC1)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.985264 |
