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4-(Tosyloxymethyl)-1-(4'-methoxyphenyl)azetidin-2-one
SpectraBase Compound ID 5eEQ13vFU3X
InChI InChI=1S/C18H19NO5S/c1-13-3-9-17(10-4-13)25(21,22)24-12-15-11-18(20)19(15)14-5-7-16(23-2)8-6-14/h3-10,15H,11-12H2,1-2H3
InChIKey SNWDHKAXCZNSPO-UHFFFAOYSA-N
Mol Weight 361.41 g/mol
Molecular Formula C18H19NO5S
Exact Mass 361.098394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3UAa47UOkZz
Name 4-(Tosyloxymethyl)-1-(4'-methoxyphenyl)azetidin-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.098393885 u
Formula C18H19NO5S
InChI InChI=1S/C18H19NO5S/c1-13-3-9-17(10-4-13)25(21,22)24-12-15-11-18(20)19(15)14-5-7-16(23-2)8-6-14/h3-10,15H,11-12H2,1-2H3
InChIKey SNWDHKAXCZNSPO-UHFFFAOYSA-N
Molecular Weight 361.412 g/mol
SMILES C1(N(C(C1)COS(=O)(=O)C=1C=CC(C)=CC1)C=1C=CC(=CC1)OC)=O