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(E)-Ethyl 6-(4-chlorophenylthio)-6,6-difluoro-3-hydroxyhex-4-enoate
SpectraBase Compound ID AGYup1l1Nbd
InChI InChI=1S/C14H15ClF2O3S/c1-2-20-13(19)9-11(18)7-8-14(16,17)21-12-5-3-10(15)4-6-12/h3-8,11,18H,2,9H2,1H3/b8-7+
InChIKey KYXKFCQQPYPJDV-BQYQJAHWSA-N
Mol Weight 336.78 g/mol
Molecular Formula C14H15ClF2O3S
Exact Mass 336.03985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPEF7TBtFuN
Name (E)-Ethyl 6-(4-chlorophenylthio)-6,6-difluoro-3-hydroxyhex-4-enoate
Alternate Name(s) (E)-ethyl 6-((4-chlorophenyl)thio)-6,6-difluoro-3-hydroxyhex-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15ClF2O3S
InChI InChI=1S/C14H15ClF2O3S/c1-2-20-13(19)9-11(18)7-8-14(16,17)21-12-5-3-10(15)4-6-12/h3-8,11,18H,2,9H2,1H3/b8-7+
InChIKey KYXKFCQQPYPJDV-BQYQJAHWSA-N
Literature Reference DOI 10.1002/cjoc.201180437
Molecular Weight 336.781 g/mol
SMILES OC(CC(=O)OCC)\C=C\C(F)(F)Sc1ccc(cc1)Cl
SPLASH splash10-00wc-2934000000-98a92e39795822de0269
Source of Spectrum CJC-29-2672-3f
Wiley ID 1772498