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THREO-3-CHLORO-2-BUTYL-BENZOATE;METHOD-A
SpectraBase Compound ID 68lwDow2pTI
InChI InChI=1S/C11H13ClO2/c1-8(12)9(2)14-11(13)10-6-4-3-5-7-10/h3-9H,1-2H3/t8-,9-/m0/s1
InChIKey SMNLXAJZTDKDSR-IUCAKERBSA-N
Mol Weight 212.68 g/mol
Molecular Formula C11H13ClO2
Exact Mass 212.060407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AI4oxoxZii8
Name THREO-3-CHLORO-2-BUTYL-BENZOATE;METHOD-A
Compound Number 5I
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C11H13ClO2/c1-8(12)9(2)14-11(13)10-6-4-3-5-7-10/h3-9H,1-2H3/t8-,9-/m0/s1
InChIKey SMNLXAJZTDKDSR-IUCAKERBSA-N
Literature Reference B.D.GLASS,A.GOOSEN,C.W.MCCLELAND J.CHEM.SOC.PERKIN-2,2175(1993)
Solvent Chloroform-d
Technique C/H SHIFT CORRELATION