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tert-Butyl {1-[chloro(p-tolylsulfinyl)methyl]cyclodecyl}acetate
SpectraBase Compound ID 1uVEug63HsI
InChI InChI=1S/C24H37ClO3S/c1-19-12-14-20(15-13-19)29(27)22(25)24(18-21(26)28-23(2,3)4)16-10-8-6-5-7-9-11-17-24/h12-15,22H,5-11,16-18H2,1-4H3
InChIKey ZSSMBQLQRKGSQQ-UHFFFAOYSA-N
Mol Weight 441.1 g/mol
Molecular Formula C24H37ClO3S
Exact Mass 440.215194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBh3RhdbucD
Name tert-Butyl {1-[chloro(p-tolylsulfinyl)methyl]cyclodecyl}acetate
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Formula C24H37ClO3S
InChI InChI=1S/C24H37ClO3S/c1-19-12-14-20(15-13-19)29(27)22(25)24(18-21(26)28-23(2,3)4)16-10-8-6-5-7-9-11-17-24/h12-15,22H,5-11,16-18H2,1-4H3
InChIKey ZSSMBQLQRKGSQQ-UHFFFAOYSA-N
Molecular Weight 441.070 g/mol
SMILES C(S(c1ccc(cc1)C)=O)(C1(CC(OC(C)(C)C)=O)CCCCCCCCC1)Cl
SPLASH splash10-0aoy-0494000000-d5eb3f29982e1e5c6489
Source of Spectrum F-59-4332-7b
Wiley ID 1678096