| SpectraBase Spectrum ID |
zuWaDzeepR |
| Name |
3-(2-Bromo-4-benzyloxy-5-methoxybenzyl)-2-methyl-4-oxocyclohex-2-enecarboxylic acid methyl ester |
| Alternate Name(s) |
methyl 3-[4-(benzyloxy)-2-bromo-5-methoxybenzyl]-2-methyl-4-oxo-2-cyclohexene-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H25BrO5 |
| InChI |
InChI=1S/C24H25BrO5/c1-15-18(24(27)29-3)9-10-21(26)19(15)11-17-12-22(28-2)23(13-20(17)25)30-14-16-7-5-4-6-8-16/h4-8,12-13,18H,9-11,14H2,1-3H3 |
| InChIKey |
URZHJGWMRNZAJC-UHFFFAOYSA-N |
| Molecular Weight |
473.363 g/mol |
| SMILES |
C1(C(=C(C(CC1)=O)Cc1c(cc(c(c1)OC)OCc1ccccc1)Br)C)C(=O)OC |
| SPLASH |
splash10-006x-0009400000-831c7e9eab0fadb5c60e |
| Source of Spectrum |
F4-0-1267-6 |
| Wiley ID |
1619545 |
