SpectraBase Spectrum ID |
HyVOCjhuONr |
Name |
Pipecolylpipecolylpipecolic acid, N-ethoxycarbonyl-, ethyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
451.268235917 u |
Formula |
C23H37N3O6 |
InChI |
InChI=1S/C23H37N3O6/c1-3-31-22(29)19-13-7-9-15-25(19)20(27)17-11-5-8-14-24(17)21(28)18-12-6-10-16-26(18)23(30)32-4-2/h17-19H,3-16H2,1-2H3 |
InChIKey |
YCHSEONDDSZZSN-UHFFFAOYSA-N |
Molecular Weight |
451.564 g/mol |
SMILES |
C1CCN(C(C1)C(OCC)=O)C(=O)C1N(CCCC1)C(=O)C1CCCCN1C(OCC)=O |