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tert-Butyl {1-[chloro(p-tolylsulfinyl)methyl]-3,3-bis(ethoxymethyl)cyclobutyl}acetate
SpectraBase Compound ID K44RmQ1JApq
InChI InChI=1S/C24H37ClO5S/c1-7-28-16-23(17-29-8-2)14-24(15-23,13-20(26)30-22(4,5)6)21(25)31(27)19-11-9-18(3)10-12-19/h9-12,21H,7-8,13-17H2,1-6H3
InChIKey XPGHTSNEQHRGLC-UHFFFAOYSA-N
Mol Weight 473.1 g/mol
Molecular Formula C24H37ClO5S
Exact Mass 472.205023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7WaGrh7YCk
Name tert-Butyl {1-[chloro(p-tolylsulfinyl)methyl]-3,3-bis(ethoxymethyl)cyclobutyl}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37ClO5S
InChI InChI=1S/C24H37ClO5S/c1-7-28-16-23(17-29-8-2)14-24(15-23,13-20(26)30-22(4,5)6)21(25)31(27)19-11-9-18(3)10-12-19/h9-12,21H,7-8,13-17H2,1-6H3
InChIKey XPGHTSNEQHRGLC-UHFFFAOYSA-N
Molecular Weight 473.068 g/mol
SMILES C1(C(S(c2ccc(cc2)C)=O)Cl)(CC(C1)(COCC)COCC)CC(OC(C)(C)C)=O
SPLASH splash10-000j-1931000000-b2c7a8463644d19e2450
Source of Spectrum F-67-1108-9
Wiley ID 1685752