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2,4,5-T -2-ETHYLHEXYLESTER
SpectraBase Compound ID 4WfwSVkplZa
InChI InChI=1S/C16H21Cl3O3/c1-3-11(2)6-4-5-7-21-16(20)10-22-15-9-13(18)12(17)8-14(15)19/h8-9,11H,3-7,10H2,1-2H3
InChIKey VFFZKFITBDSWHM-UHFFFAOYSA-N
Mol Weight 367.7 g/mol
Molecular Formula C16H21Cl3O3
Exact Mass 366.055628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FrLrjy6jb9
Name 2,4,5-T -2-ETHYLHEXYLESTER
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 366.055627633 u
Formula C16H21Cl3O3
InChI InChI=1S/C16H21Cl3O3/c1-3-11(2)6-4-5-7-21-16(20)10-22-15-9-13(18)12(17)8-14(15)19/h8-9,11H,3-7,10H2,1-2H3
InChIKey VFFZKFITBDSWHM-UHFFFAOYSA-N
Molecular Weight 367.700 g/mol
Nominal Mass 366 u
Number of Peaks 82
SMILES c1(Cl)c(cc(OCC(=O)OCCCCC(C)CC)c(Cl)c1)Cl
SPLASH splash10-0abc-9110000000-6dd4e89457e3aeb61635
Source of Spectrum Dr. Rolf Kuehnle
Synonyms 5-methylheptyl (2,4,5-trichlorophenoxy)acetate
Technique GC/MS
Wiley ID WID_MSPA_3901