SpectraBase Compound ID | HE6PBWZLuxR |
---|---|
InChI | InChI=1S/C18H27NO4/c1-3-4-5-6-7-8-13-23-18(21)17(20)19-14-15-9-11-16(22-2)12-10-15/h9-12H,3-8,13-14H2,1-2H3,(H,19,20) |
InChIKey | WPDVBUPTUKWJEP-UHFFFAOYSA-N |
Mol Weight | 321.42 g/mol |
Molecular Formula | C18H27NO4 |
Exact Mass | 321.194008 g/mol |
SpectraBase Spectrum ID | AU2AZWQxC4Q |
---|---|
Name | Oxalic acid, monoamide, N-(4-methoxybenzyl)-, octyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 321.194008349 u |
Formula | C18H27NO4 |
InChI | InChI=1S/C18H27NO4/c1-3-4-5-6-7-8-13-23-18(21)17(20)19-14-15-9-11-16(22-2)12-10-15/h9-12H,3-8,13-14H2,1-2H3,(H,19,20) |
InChIKey | WPDVBUPTUKWJEP-UHFFFAOYSA-N |
Molecular Weight | 321.417 g/mol |
SMILES | CCCCCCCCOC(C(=O)NCC1=CC=C(C=C1)OC)=O |