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4-Oxazolidinepropanoic acid, 2,2-bis(chlorodifluoromethyl)-5-oxo-, 2-chloro-1-(chlorodifluoromethyl)-2,2-difluoro-1-methoxyethyl ester

View entire compound with spectra: 1 MS (GC)

4-Oxazolidinepropanoic acid, 2,2-bis(chlorodifluoromethyl)-5-oxo-, 2-chloro-1-(chlorodifluoromethyl)-2,2-difluoro-1-methoxyethyl ester
SpectraBase Compound ID 2NzU4foVw1l
InChI InChI=1S/C12H9Cl4F8NO5/c1-28-8(11(15,21)22,12(16,23)24)29-5(26)3-2-4-6(27)30-7(25-4,9(13,17)18)10(14,19)20/h4,25H,2-3H2,1H3
InChIKey PXCJNXDWSZGDOH-UHFFFAOYSA-N
Mol Weight 541.0 g/mol
Molecular Formula C12H9Cl4F8NO5
Exact Mass 538.910708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVo7dYtlrcM
Name 4-Oxazolidinepropanoic acid, 2,2-bis(chlorodifluoromethyl)-5-oxo-, 2-chloro-1-(chlorodifluoromethyl)-2,2-difluoro-1-methoxyethyl ester
CAS Registry Number 73997-88-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9Cl4F8NO5
InChI InChI=1S/C12H9Cl4F8NO5/c1-28-8(11(15,21)22,12(16,23)24)29-5(26)3-2-4-6(27)30-7(25-4,9(13,17)18)10(14,19)20/h4,25H,2-3H2,1H3
InChIKey PXCJNXDWSZGDOH-UHFFFAOYSA-N
Molecular Weight 541.005 g/mol
SMILES N1C(C(OC1(C(Cl)(F)F)C(F)(F)Cl)=O)CCC(OC(C(F)(F)Cl)(C(F)(F)Cl)OC)=O
SPLASH splash10-001r-9882000000-f84d9fb4fd2341570f83
Source of Spectrum KO-6-386-17
Synonyms 2,2-bis(chlorodifluoromethyl)-4-(2-(methoxybis(difluorochloromethyl)methoxycarbonyl)ethyl)-1,3-oxazolidinone 2-Chloro-1-[chloro(difluoro)methyl]-2,2-difluoro-1-methoxyethyl 3-{2,2-bis[chloro(difluoro)methyl]-5-oxo-1,3-oxazolidin-4-yl}propanoate
Wiley ID 1404434