| SpectraBase Spectrum ID |
9UgX86XS4ub |
| Name |
Methyl 3-(2-Bromo-6-methoxy-4-methylphenyl)-8-methoxy-1,4-naphthoquinone-2-carboxylate |
| Alternate Name(s) |
methyl 3-(2-bromo-6-methoxy-4-methylphenyl)-8-methoxy-1,4-dioxo-1,4-dihydro-2-naphthalenecarboxylate |
| CAS Registry Number |
139976-17-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H17BrO6 |
| InChI |
InChI=1S/C21H17BrO6/c1-10-8-12(22)16(14(9-10)27-3)17-18(21(25)28-4)20(24)15-11(19(17)23)6-5-7-13(15)26-2/h5-9H,1-4H3 |
| InChIKey |
FIHYJNOIECGLQH-UHFFFAOYSA-N |
| Molecular Weight |
445.265 g/mol |
| SMILES |
C1(=C(C(=O)c2c(C1=O)c(OC)ccc2)c1c(cc(cc1OC)C)Br)C(=O)OC |
| SPLASH |
splash10-001i-0009100000-c871da01b3a108b35e23 |
| Source of Spectrum |
J-57-2781-37 |
| Wiley ID |
1385898 |
