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Bis(4-chlorophenyl)acetic acid
SpectraBase Compound ID 5mgOhPXRRX4
InChI InChI=1S/C14H10Cl2O2/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8,13H,(H,17,18)
InChIKey YIOCIFXUGBYCJR-UHFFFAOYSA-N
Mol Weight 281.14 g/mol
Molecular Formula C14H10Cl2O2
Exact Mass 280.005785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlEMgQO1eA4
Name 4,4'-DDA
CAS Registry Number 83-05-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 280.005784960 u
Formula C14H10Cl2O2
InChI InChI=1S/C14H10Cl2O2/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8,13H,(H,17,18)
InChIKey YIOCIFXUGBYCJR-UHFFFAOYSA-N
Molecular Weight 281.138 g/mol
Nominal Mass 280 u
Number of Peaks 85
SMILES OC(C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)=O
SPLASH splash10-000i-3590000000-f7e31baa152107e20fa8
Source of Spectrum Dr. Rolf Kuehnle
Synonyms bis(4-chlorophenyl)acetic acid 2,2-bis(4-chlorophenyl)acetic acid
Technique GC/MS
Wiley ID WID_MSPA_3369