| SpectraBase Spectrum ID |
Iup60hNHJ8g |
| Name |
ile-ile-ile, N,N',N''-Trimethyl-N-(N-propyloxycarbonyl)-, methyl ester (isomer 2) |
| 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/c1-12-16-35-26(33)29(10)21(18(6)14-3)24(31)27(8)20(17(5)13-2)23(30)28(9)22(19(7)15-4)25(32)34-11/h17-22H,12-16H2,1-11H3 |
| InChIKey |
MEERFLHZRISYST-UHFFFAOYSA-N |
| Molecular Weight |
499.693 g/mol |
| SMILES |
CCC(C(C(N(C(C(CC)C)C(N(C(C(CC)C)C(OC)=O)C)=O)C)=O)N(C)C(OCCC)=O)C |
