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Ethyl 4-acetyl-3-(.omega.-chlorohexafluoropropyl)-5-hydroxyhexa-2,4-diencarboxylate
SpectraBase Compound ID GqPKDTKeloO
InChI InChI=1S/C13H13ClF6O4/c1-4-24-9(23)5-8(10(6(2)21)7(3)22)11(15,16)12(17,18)13(14,19)20/h5,21H,4H2,1-3H3/b8-5-,10-6-
InChIKey MOUCYLPDADKOPY-UQZKWGPRSA-N
Mol Weight 382.69 g/mol
Molecular Formula C13H13ClF6O4
Exact Mass 382.040656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ih2pfFL3EmQ
Name Ethyl 4-acetyl-3-(.omega.-chlorohexafluoropropyl)-5-hydroxyhexa-2,4-diencarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClF6O4
InChI InChI=1S/C13H13ClF6O4/c1-4-24-9(23)5-8(10(6(2)21)7(3)22)11(15,16)12(17,18)13(14,19)20/h5,21H,4H2,1-3H3/b8-5-,10-6-
InChIKey MOUCYLPDADKOPY-UQZKWGPRSA-N
Molecular Weight 382.686 g/mol
SMILES O\C(=C/(\C(C(C(C(Cl)(F)F)(F)F)(F)F)=C\C(=O)OCC)C(=O)C)C
SPLASH splash10-0016-0029000000-db893c20ee09ab9ded5f
Source of Spectrum SO-0-1366-6
Synonyms Ethyl (2Z,4E)-4-acetyl-3-(3-chloro-1,1,2,2,3,3-hexafluoropropyl)-5-hydroxy-2,4-hexadienoate
Wiley ID 874164