| SpectraBase Compound ID | LPvXT6MnTBx |
|---|---|
| InChI | InChI=1S/C18H15BrClNO4/c1-25-18(24)14(19)9-10-8-11(6-7-15(10)20)21-16(22)12-4-2-3-5-13(12)17(21)23/h6-9H,2-5H2,1H3/b14-9- |
| InChIKey | KZNDKQFADUDXCT-ZROIWOOFSA-N |
| Mol Weight | 424.68 g/mol |
| Molecular Formula | C18H15BrClNO4 |
| Exact Mass | 422.987299 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | FwS7O8cTEzb |
|---|---|
| Name | 2-Propenoic acid, 2-bromo-3-[2-chloro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)phenyl]-, methyl ester |
| CAS Registry Number | 111126-05-7 |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C18H15BrClNO4 |
| InChI | InChI=1S/C18H15BrClNO4/c1-25-18(24)14(19)9-10-8-11(6-7-15(10)20)21-16(22)12-4-2-3-5-13(12)17(21)23/h6-9H,2-5H2,1H3/b14-9- |
| InChIKey | KZNDKQFADUDXCT-ZROIWOOFSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | KBr-Pellet |