| SpectraBase Spectrum ID |
AnPBtP50Bng |
| Name |
methyl 2-[4-[2-[1,3-benzoxazol-2-yl(heptyl)amino]ethyl]phenoxy]-2-methyl-propanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36N2O4 |
| InChI |
InChI=1S/C27H36N2O4/c1-5-6-7-8-11-19-29(26-28-23-12-9-10-13-24(23)32-26)20-18-21-14-16-22(17-15-21)33-27(2,3)25(30)31-4/h9-10,12-17H,5-8,11,18-20H2,1-4H3 |
| InChIKey |
SPZUCMVOJSMPSN-UHFFFAOYSA-N |
| Instrument Name |
HP 6890-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm201306q |
| Molecular Weight |
452.595 g/mol |
| SMILES |
c1ccc2nc(N(CCc3ccc(OC(C)(C(=O)OC)C)cc3)CCCCCCC)oc2c1 |
| SPLASH |
splash10-03di-0901000000-52e89bf5b81f3dfa9e4c |
| Source of Spectrum |
AF-55-SM3-3-3 |
| Wiley ID |
1851988 |
![methyl 2-[4-[2-[1,3-benzoxazol-2-yl(heptyl)amino]ethyl]phenoxy]-2-methyl-propanoate](/api/spectrum/AnPBtP50Bng/structure.png?h=300&w=458 "methyl 2-[4-[2-[1,3-benzoxazol-2-yl(heptyl)amino]ethyl]phenoxy]-2-methyl-propanoate")
