SpectraBase Compound ID | 1d4wGrA86Gu |
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InChI | InChI=1S/C14H8Cl2O2/c15-13(17)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(16)18/h1-8H |
InChIKey | QDBOAKPEXMMQFO-UHFFFAOYSA-N |
Mol Weight | 279.12 g/mol |
Molecular Formula | C14H8Cl2O2 |
Exact Mass | 277.990135 g/mol |
SpectraBase Spectrum ID | J1ybEaczuz8 |
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Name | [1,1'-Biphenyl]-4,4'-dicarbonyl dichloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 277.990134896 u |
Formula | C14H8Cl2O2 |
InChI | InChI=1S/C14H8Cl2O2/c15-13(17)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(16)18/h1-8H |
InChIKey | QDBOAKPEXMMQFO-UHFFFAOYSA-N |
SMILES | C1(=CC=C(C=C1)C(Cl)=O)C1=CC=C(C=C1)C(Cl)=O |
Spectrum/Structure Validation Score (Raman) | 0.988394 |