| SpectraBase Spectrum ID |
7Qk4oMKLLTS |
| Name |
(4-Nitrophenyl) 3-[4-[bis(4-methoxyphenyl)-oxidanyl-methyl]phenyl]propanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
513.178752206 u |
| Formula |
C30H27NO7 |
| InChI |
InChI=1S/C30H27NO7/c1-36-26-14-8-23(9-15-26)30(33,24-10-16-27(37-2)17-11-24)22-6-3-21(4-7-22)5-20-29(32)38-28-18-12-25(13-19-28)31(34)35/h3-4,6-19,33H,5,20H2,1-2H3 |
| InChIKey |
FPNDNRDSAFTNAB-UHFFFAOYSA-N |
| Molecular Weight |
513.546 g/mol |
| SMILES |
C1(N(=O)=O)=CC=C(OC(=O)CCC2=CC=C(C(C=3C=CC(=CC3)OC)(C=3C=CC(=CC3)OC)O)C=C2)C=C1 |