SpectraBase Spectrum ID |
DiDCClQTPU5 |
Name |
Tripropyl 2,2',2''-nitrilotriacetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.183837587 u |
Formula |
C15H27NO6 |
InChI |
InChI=1S/C15H27NO6/c1-4-7-20-13(17)10-16(11-14(18)21-8-5-2)12-15(19)22-9-6-3/h4-12H2,1-3H3 |
InChIKey |
MIPJXOBXIBQDAO-UHFFFAOYSA-N |
Molecular Weight |
317.382 g/mol |
SMILES |
C(C(=O)OCCC)N(CC(=O)OCCC)CC(=O)OCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973786 |