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Phenyl 6,6-dichloro-7,7,7-trifluoro-4-(trifluoromethyl)heptanoate
SpectraBase Compound ID 2BfDoa8Gsf6
InChI InChI=1S/C14H12Cl2F6O2/c15-12(16,14(20,21)22)8-9(13(17,18)19)6-7-11(23)24-10-4-2-1-3-5-10/h1-5,9H,6-8H2
InChIKey DGBMDUCMKJUSQG-UHFFFAOYSA-N
Mol Weight 397.14 g/mol
Molecular Formula C14H12Cl2F6O2
Exact Mass 396.011854 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wpbtE8GPhG
Name Phenyl 6,6-dichloro-7,7,7-trifluoro-4-(trifluoromethyl)heptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12Cl2F6O2
InChI InChI=1S/C14H12Cl2F6O2/c15-12(16,14(20,21)22)8-9(13(17,18)19)6-7-11(23)24-10-4-2-1-3-5-10/h1-5,9H,6-8H2
InChIKey DGBMDUCMKJUSQG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201900075
Molecular Weight 397.144 g/mol
SMILES C(CC(C(F)(F)F)(Cl)Cl)(CCC(Oc1ccccc1)=O)C(F)(F)F
SPLASH splash10-0006-9100000000-a7ff83ada38f4705372f
Source of Spectrum CJC-37-SM30-5n
Wiley ID 1819512