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3,3-Di-tert-butyl-4-thioxo-1-tosyl-2-azetidinone
SpectraBase Compound ID C32pftoRlis
InChI InChI=1S/C18H25NO3S2/c1-12-8-10-13(11-9-12)24(21,22)19-14(20)18(15(19)23,16(2,3)4)17(5,6)7/h8-11H,1-7H3
InChIKey KDKCVBMIARKBPF-UHFFFAOYSA-N
Mol Weight 367.52 g/mol
Molecular Formula C18H25NO3S2
Exact Mass 367.127586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSoHginz8Yl
Name 3,3-Di-tert-butyl-4-thioxo-1-tosyl-2-azetidinone
Alternate Name(s) 3,3-Ditert-butyl-1-[(4-methylphenyl)sulfonyl]-4-thioxo-2-azetidinone
CAS Registry Number 77297-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO3S2
InChI InChI=1S/C18H25NO3S2/c1-12-8-10-13(11-9-12)24(21,22)19-14(20)18(15(19)23,16(2,3)4)17(5,6)7/h8-11H,1-7H3
InChIKey KDKCVBMIARKBPF-UHFFFAOYSA-N
Molecular Weight 367.522 g/mol
SMILES c1(S(N2C(=S)C(C2=O)(C(C)(C)C)C(C)(C)C)(=O)=O)ccc(cc1)C
SPLASH splash10-0f79-2900000000-e58bbd441cee4c285526
Source of Spectrum K-121-696-3
Wiley ID 1352486