| SpectraBase Spectrum ID |
JAsJyURpgh5 |
| Name |
ile-ile-ile, N,N',N''-Trimethyl-N-ethoxycarbonyl-, ethyl ester (isomer 1) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
499.362136304 u |
| Formula |
C26H49N3O6 |
| InChI |
InChI=1S/C26H49N3O6/c1-12-17(6)20(23(30)28(10)22(19(8)14-3)25(32)34-15-4)27(9)24(31)21(18(7)13-2)29(11)26(33)35-16-5/h17-22H,12-16H2,1-11H3 |
| InChIKey |
PKDZCOYGJZTJJI-UHFFFAOYSA-N |
| Molecular Weight |
499.693 g/mol |
| SMILES |
CCC(C(C(N(C(C(CC)C)C(N(C(C(CC)C)C(OCC)=O)C)=O)C)=O)N(C)C(OCC)=O)C |
