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5,5-Dimethyl-4-(3-methyl-3-phenylcyclobutylidene)-3-p-toluenesulfonyloxazolidin-2-one
SpectraBase Compound ID 7YvJIbSP4Ix
InChI InChI=1S/C23H25NO4S/c1-16-10-12-19(13-11-16)29(26,27)24-20(22(2,3)28-21(24)25)17-14-23(4,15-17)18-8-6-5-7-9-18/h5-13H,14-15H2,1-4H3/b20-17-
InChIKey QICMXZGSUXSHAF-JZJYNLBNSA-N
Mol Weight 411.52 g/mol
Molecular Formula C23H25NO4S
Exact Mass 411.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jzz2MHssQ2o
Name 5,5-Dimethyl-4-(3-methyl-3-phenylcyclobutylidene)-3-p-toluenesulfonyloxazolidin-2-one
Alternate Name(s) 5,5-dimethyl-4-(3-methyl-3-phenylcyclobutylidene)-3-[(4-methylphenyl)sulfonyl]-1,3-oxazolidin-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C23H25NO4S
InChI InChI=1S/C23H25NO4S/c1-16-10-12-19(13-11-16)29(26,27)24-20(22(2,3)28-21(24)25)17-14-23(4,15-17)18-8-6-5-7-9-18/h5-13H,14-15H2,1-4H3/b20-17-
InChIKey QICMXZGSUXSHAF-JZJYNLBNSA-N
Molecular Weight 411.516 g/mol
SMILES C1(OC(C(N1S(=O)(=O)c1ccc(cc1)C)=C1CC(C1)(c1ccccc1)C)(C)C)=O
SPLASH splash10-0a4i-0090000000-bb2b61047c49ae4e7409
Source of Spectrum QF-9-2434-7
Wiley ID 1558379