SpectraBase Compound ID | 2xZ5lbAeQ3a |
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InChI | InChI=1S/C15H10Cl2O/c16-12-7-3-1-5-10(12)15-9-13(17)11-6-2-4-8-14(11)18-15/h1-9,15H |
InChIKey | CACDKMFOGILMJX-UHFFFAOYSA-N |
Mol Weight | 277.15 g/mol |
Molecular Formula | C15H10Cl2O |
Exact Mass | 276.01087 g/mol |
SpectraBase Spectrum ID | qqMSLagome |
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Name | 4-Chloro-2-(2-chlorophenyl)-2H-chromene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 276.010870341 u |
Formula | C15H10Cl2O |
InChI | InChI=1S/C15H10Cl2O/c16-12-7-3-1-5-10(12)15-9-13(17)11-6-2-4-8-14(11)18-15/h1-9,15H |
InChIKey | CACDKMFOGILMJX-UHFFFAOYSA-N |
SMILES | C1(C=C(Cl)C2=C(O1)C=CC=C2)C=1C(Cl)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962969 |