| SpectraBase Spectrum ID |
4d3zWKoFZxN |
| Name |
2-(2-Bromo-4-benzyloxy-5-methoxybenzyl)-3-ethylidene-1-methylcyclohexanecarboxylic acid methyl ester |
| Alternate Name(s) |
methyl (3E)-2-[4-(benzyloxy)-2-bromo-5-methoxybenzyl]-3-ethylidene-1-methylcyclohexanecarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H31BrO4 |
| InChI |
InChI=1S/C26H31BrO4/c1-5-19-12-9-13-26(2,25(28)30-4)21(19)14-20-15-23(29-3)24(16-22(20)27)31-17-18-10-7-6-8-11-18/h5-8,10-11,15-16,21H,9,12-14,17H2,1-4H3/b19-5+ |
| InChIKey |
AMLOESPNWYTOLS-PTXOJBNSSA-N |
| Molecular Weight |
487.434 g/mol |
| SMILES |
C1(C(C(=O)OC)(CCC\C1=C\C)C)Cc1c(cc(c(c1)OC)OCc1ccccc1)Br |
| SPLASH |
splash10-0006-9000400000-0a02805d38ce40923b99 |
| Source of Spectrum |
F4-0-1269-10 |
| Wiley ID |
1619530 |
