| SpectraBase Spectrum ID |
KwUqvTcNhPA |
| Name |
1,4-Dihydro-2-methyl-1,4-dioxonaphthalen-3-yl 4-bromobutanoate |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H13BrO4 |
| InChI |
InChI=1S/C15H13BrO4/c1-9-13(18)10-5-2-3-6-11(10)14(19)15(9)20-12(17)7-4-8-16/h2-3,5-6H,4,7-8H2,1H3 |
| InChIKey |
WNMXXXDYFYINIC-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/ml300242v |
| Molecular Weight |
337.169 g/mol |
| SMILES |
C=1(C(c2c(C(C1OC(=O)CCCBr)=O)cccc2)=O)C |
| SPLASH |
splash10-0002-0900000000-ca60447d69c2bb33e336 |
| Source of Spectrum |
MCS-3-SM4-25a |
| Thin-Layer Chromatography |
Rf = 0.45 (hexanes/EtOAc, 5:1) |
| Wiley ID |
1864058 |
