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7-Chloro-3-[2,4-dichlorophenyl]-3,4-dihydro-1H-thioxanthene-1,9(2H)-dioone
SpectraBase Compound ID 6KiX4tHqzAw
InChI InChI=1S/C19H11Cl3O2S/c20-10-2-4-16-13(7-10)19(24)18-15(23)5-9(6-17(18)25-16)12-3-1-11(21)8-14(12)22/h1-4,7-9H,5-6H2
InChIKey HYYFBWKVOQROMR-UHFFFAOYSA-N
Mol Weight 409.71 g/mol
Molecular Formula C19H11Cl3O2S
Exact Mass 407.954534 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 46nr9zjQ09x
Name 7-Chloro-3-[2,4-dichlorophenyl]-3,4-dihydro-1H-thioxanthene-1,9(2H)-dioone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.954533866 u
Formula C19H11Cl3O2S
InChI InChI=1S/C19H11Cl3O2S/c20-10-2-4-16-13(7-10)19(24)18-15(23)5-9(6-17(18)25-16)12-3-1-11(21)8-14(12)22/h1-4,7-9H,5-6H2
InChIKey HYYFBWKVOQROMR-UHFFFAOYSA-N
Molecular Weight 409.714 g/mol
SMILES C1(=CC=C(C(=C1)Cl)C1CC(C2=C(SC3=CC=C(C=C3C2=O)Cl)C1)=O)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.844874