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tert-Butyl 3-[chloro(p-tolylsulfinyl)methyl]-2-methyl-5-phenylpentanoate
SpectraBase Compound ID IRSsEH4KLHI
InChI InChI=1S/C24H31ClO3S/c1-17-11-14-20(15-12-17)29(27)22(25)21(16-13-19-9-7-6-8-10-19)18(2)23(26)28-24(3,4)5/h6-12,14-15,18,21-22H,13,16H2,1-5H3
InChIKey RIOWOJCPVAHPMN-UHFFFAOYSA-N
Mol Weight 435.02 g/mol
Molecular Formula C24H31ClO3S
Exact Mass 434.168244 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZHZ4s5ROil
Name tert-Butyl 3-[chloro(p-tolylsulfinyl)methyl]-2-methyl-5-phenylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31ClO3S
InChI InChI=1S/C24H31ClO3S/c1-17-11-14-20(15-12-17)29(27)22(25)21(16-13-19-9-7-6-8-10-19)18(2)23(26)28-24(3,4)5/h6-12,14-15,18,21-22H,13,16H2,1-5H3
InChIKey RIOWOJCPVAHPMN-UHFFFAOYSA-N
Molecular Weight 435.022 g/mol
SMILES C(S(c1ccc(cc1)C)=O)(C(C(C(OC(C)(C)C)=O)C)CCc1ccccc1)Cl
SPLASH splash10-0006-3910000000-a60f7588a335e5c5fd3a
Source of Spectrum F-59-4332-8e
Wiley ID 1678089