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alpha,alpha'-dichloro-5-methyl-1,3-adamantanediacetic acid, dimethyl ester
SpectraBase Compound ID 3sOmKCSLPfM
InChI InChI=1S/C17H24Cl2O4/c1-15-4-10-5-16(7-15,11(18)13(20)22-2)9-17(6-10,8-15)12(19)14(21)23-3/h10-12H,4-9H2,1-3H3/t10-,11?,12?,15+,16+,17-
InChIKey CVXXIEHPXVKDSF-NUMWDKGISA-N
Mol Weight 363.28 g/mol
Molecular Formula C17H24Cl2O4
Exact Mass 362.105165 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1GEn7sWhmnc
Name alpha,alpha'-DICHLORO-5-METHYL-1,3-ADAMATANEDIACETIC ACID, DIMETHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24Cl2O4
InChI InChI=1S/C17H24Cl2O4/c1-15-4-10-5-16(7-15,11(18)13(20)22-2)9-17(6-10,8-15)12(19)14(21)23-3/h10-12H,4-9H2,1-3H3/t10-,11?,12?,15+,16+,17-
InChIKey CVXXIEHPXVKDSF-NUMWDKGISA-N
Molecular Weight 363.28
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 1,3-ADAMANTANEDIACETIC ACID, A,A'-DICHLORO-5-METHYL-, DIMETHYL ESTER