| SpectraBase Spectrum ID |
9dahR4rdUHx |
| Name |
8-(3-bromo-2,5-diketo-3-pyrrolin-1-yl)caprylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16BrNO4 |
| InChI |
InChI=1S/C12H16BrNO4/c13-9-8-10(15)14(12(9)18)7-5-3-1-2-4-6-11(16)17/h8H,1-7H2,(H,16,17) |
| InChIKey |
JALZEEFEBIAELB-UHFFFAOYSA-N |
| Molecular Weight |
318.167 g/mol |
| SMILES |
OC(CCCCCCCN1C(C(Br)=CC1=O)=O)=O |
| SPLASH |
splash10-0abc-5901000000-57e75e43d4077d0d6809 |
| Source of Spectrum |
E1-39-1700-56 |
| Synonyms |
8-(3-bromo-2,5-dioxo-1-pyrrolyl)octanoic acid
8-(3-bromo-2,5-dioxo-pyrrol-1-yl)octanoic acid
8-[3-bromanyl-2,5-bis(oxidanylidene)pyrrol-1-yl]octanoic acid |
| Wiley ID |
1598710 |
