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(3S,4R)-3-Butyl-1-(toluene-4-sulfonyl)-4-trifluoromethyl-azetidin-2-one
SpectraBase Compound ID 6XNvVHUy0Rh
InChI InChI=1S/C15H18F3NO3S/c1-3-4-5-12-13(15(16,17)18)19(14(12)20)23(21,22)11-8-6-10(2)7-9-11/h6-9,12-13H,3-5H2,1-2H3/t12-,13+/m0/s1
InChIKey UUBUGOFIYLGXOX-QWHCGFSZSA-N
Mol Weight 349.37 g/mol
Molecular Formula C15H18F3NO3S
Exact Mass 349.095949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HdZP87qaG
Name (3S,4R)-3-Butyl-1-(toluene-4-sulfonyl)-4-trifluoromethyl-azetidin-2-one
Alternate Name(s) trans-1-Tosyl-3-butyl-4-(trifluoromethyl)azetidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18F3NO3S
InChI InChI=1S/C15H18F3NO3S/c1-3-4-5-12-13(15(16,17)18)19(14(12)20)23(21,22)11-8-6-10(2)7-9-11/h6-9,12-13H,3-5H2,1-2H3/t12-,13+/m0/s1
InChIKey UUBUGOFIYLGXOX-QWHCGFSZSA-N
Molecular Weight 349.368 g/mol
SMILES c1(S(N2[C@@](C(F)(F)F)([C@@](C2=O)(CCCC)[H])[H])(=O)=O)ccc(cc1)C
SPLASH splash10-0a6u-5906000000-c6c90179d85b887301b9
Source of Spectrum F-67-3258-5e
Wiley ID 1686317