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2,4,5-Trichloronaphthalic anhydride

View entire compound with spectra: 1 FTIR, and 1 Raman

2,4,5-Trichloronaphthalic anhydride
SpectraBase Compound ID BP0y33qUDaF
InChI InChI=1S/C12H3Cl3O3/c13-5-2-1-4-8-9(5)6(14)3-7(15)10(8)12(17)18-11(4)16/h1-3H
InChIKey OLDDXBCEAAZLMM-UHFFFAOYSA-N
Mol Weight 301.51 g/mol
Molecular Formula C12H3Cl3O3
Exact Mass 299.914777 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 8b7D9FkG3gH
Name 2,4,5-Trichloronaphthalic anhydride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.914777054 u
Formula C12H3Cl3O3
InChI InChI=1S/C12H3Cl3O3/c13-5-2-1-4-8-9(5)6(14)3-7(15)10(8)12(17)18-11(4)16/h1-3H
InChIKey OLDDXBCEAAZLMM-UHFFFAOYSA-N
Molecular Weight 301.512 g/mol
SMILES C1(=O)OC(=O)C=2C=3C1=CC=C(C3C(=CC2Cl)Cl)Cl
Spectrum/Structure Validation Score (Raman) 0.866269