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3-Chloro-2-methyl-3-(p-tolylsulfonyl)-4-decanone
SpectraBase Compound ID 86QnX6x34UL
InChI InChI=1S/C18H27ClO3S/c1-5-6-7-8-9-17(20)18(19,14(2)3)23(21,22)16-12-10-15(4)11-13-16/h10-14H,5-9H2,1-4H3
InChIKey NEIGLFKWQORZKU-UHFFFAOYSA-N
Mol Weight 358.92 g/mol
Molecular Formula C18H27ClO3S
Exact Mass 358.136944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4c9a4NLwnwR
Name 3-Chloro-2-methyl-3-(p-tolylsulfonyl)-4-decanone
Alternate Name(s) 3-Chloro-2-methyl-3-[(4-methylphenyl)sulfonyl]-4-decanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27ClO3S
InChI InChI=1S/C18H27ClO3S/c1-5-6-7-8-9-17(20)18(19,14(2)3)23(21,22)16-12-10-15(4)11-13-16/h10-14H,5-9H2,1-4H3
InChIKey NEIGLFKWQORZKU-UHFFFAOYSA-N
Molecular Weight 358.924 g/mol
SMILES CC(C(C(CCCCCC)=O)(S(=O)(=O)c1ccc(cc1)C)Cl)C
SPLASH splash10-03di-0900000000-dfdf6716a7fa43a9d4c7
Source of Spectrum AJ-66-2343-2
Wiley ID 772190