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3-Chloro-3-[(3'-chlorophenylazetidin-1'-yl)sulfanyl]-2,2,4,4-tetramethylcyclobutanone
SpectraBase Compound ID KXiEah1MtM7
InChI InChI=1S/C17H21Cl2NOS/c1-14(2)13(21)15(3,4)17(14,19)22-20-10-16(18,11-20)12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3
InChIKey GFDGJKWYEWDMIJ-UHFFFAOYSA-N
Mol Weight 358.33 g/mol
Molecular Formula C17H21Cl2NOS
Exact Mass 357.072091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 462m6hSRpg
Name 3-Chloro-3-[(3-chloro-3-phenylazetidin-1-yl)sulfanyl]-2,2,4,4-tetramethylcyclobutanone
Alternate Name(s) 3-Chloro-3-((3-chloro-3-phenylazetidin-1-yl)thio)-2,2,4,4-tetramethylcyclobutan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21Cl2NOS
InChI InChI=1S/C17H21Cl2NOS/c1-14(2)13(21)15(3,4)17(14,19)22-20-10-16(18,11-20)12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3
InChIKey GFDGJKWYEWDMIJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200890154
Molecular Weight 358.327 g/mol
SMILES C1(C(C(C1(C)C)(SN1CC(C1)(c1ccccc1)Cl)Cl)(C)C)=O
SPLASH splash10-0fgp-2901000000-cc7a5b1767490fa701a8
Source of Spectrum H-91-1425-8a
Wiley ID 1785750