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Dichlorodiphenyltrichloroethane
SpectraBase Compound ID 2LvQCLBamih
InChI InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H
InChIKey YVGGHNCTFXOJCH-UHFFFAOYSA-N
Mol Weight 354.5 g/mol
Molecular Formula C14H9Cl5
Exact Mass 351.914689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoWxYZzYV7s
Name 4,4'-DDT
CAS Registry Number 50-29-3
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 351.914688790 u
Formula C14H9Cl5
InChI InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H
InChIKey YVGGHNCTFXOJCH-UHFFFAOYSA-N
Molecular Weight 354.491 g/mol
Nominal Mass 352 u
Number of Peaks 100
SMILES c1c(ccc(c1)Cl)C(c1ccc(cc1)Cl)C(Cl)(Cl)Cl
SPLASH splash10-000i-2490000000-94f4a6b1ce6b025bd299
Source of Spectrum Dr. Rolf Kuehnle
Synonyms 1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene 4,4'-(2,2,2-trichloroethane-1,1-diyl)bis(chlorobenzene) 1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane 1,1-Bis(4-chlorophenyl)-2,2,2-trichloroethane
Technique GC/MS
Wiley ID WID_MSPA_3357