| SpectraBase Spectrum ID |
GT4l2Icsmk2 |
| Name |
dl-Alanyl-dl-alanyl-dl-alanine, N,N',N''-trimethyl-N''-octyloxycarbonyl-, octyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
541.409086497 u |
| Formula |
C29H55N3O6 |
| InChI |
InChI=1S/C29H55N3O6/c1-9-11-13-15-17-19-21-37-28(35)25(5)31(7)26(33)23(3)30(6)27(34)24(4)32(8)29(36)38-22-20-18-16-14-12-10-2/h23-25H,9-22H2,1-8H3 |
| InChIKey |
PQQDOLGKLAJPMB-UHFFFAOYSA-N |
| Molecular Weight |
541.774 g/mol |
| SMILES |
C(C(N(C)C(C(N(C(C(N(C)C(OCCCCCCCC)=O)C)=O)C)C)=O)C)(OCCCCCCCC)=O |
