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1-(4-tert-butylphenyl)-3-chloro-3,3-difluoro-propyl] 2-chloro-2,2-difluoro-acetate
SpectraBase Compound ID GAJvSBcFhR5
InChI InChI=1S/C15H16Cl2F4O2/c1-13(2,3)10-6-4-9(5-7-10)11(8-14(16,18)19)23-12(22)15(17,20)21/h4-7,11H,8H2,1-3H3
InChIKey QOTQEEDEHRCLPL-UHFFFAOYSA-N
Mol Weight 375.19 g/mol
Molecular Formula C15H16Cl2F4O2
Exact Mass 374.046348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFQ0vDj93ZS
Name 1-(4-tert-butylphenyl)-3-chloro-3,3-difluoro-propyl] 2-chloro-2,2-difluoro-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.046347805 u
Formula C15H16Cl2F4O2
InChI InChI=1S/C15H16Cl2F4O2/c1-13(2,3)10-6-4-9(5-7-10)11(8-14(16,18)19)23-12(22)15(17,20)21/h4-7,11H,8H2,1-3H3
InChIKey QOTQEEDEHRCLPL-UHFFFAOYSA-N
Instrument Name Agilent 8890-5977B
Ionization Type EI
Literature Reference DOI 10.1002/anie.202209143
Molecular Weight 375.191 g/mol
Quality 775
SMILES C1=C(C=CC(=C1)C(C)(C)C)C(OC(C(Cl)(F)F)=O)CC(Cl)(F)F
SPLASH splash10-08fr-0219000000-0dc38d5f7b5258e96c54
Source of Spectrum ACI-61-SM47-3 (DOI: 10.1002/anie.202209143)
Wiley ID 1899515