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Urea, N-[2,5-dihydro-2,2-dimethyl-5-oxo-4-(phenylsulfinyl)-3-furanyl]-N'-(1,1-dimethylethyl)-
SpectraBase Compound ID joDXfNIeGH
InChI InChI=1S/C17H22N2O4S/c1-16(2,3)19-15(21)18-13-12(14(20)23-17(13,4)5)24(22)11-9-7-6-8-10-11/h6-10H,1-5H3,(H2,18,19,21)
InChIKey COCLTMUPELRPJC-UHFFFAOYSA-N
Mol Weight 350.43 g/mol
Molecular Formula C17H22N2O4S
Exact Mass 350.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jp4xossQScC
Name Urea, N-[2,5-dihydro-2,2-dimethyl-5-oxo-4-(phenylsulfinyl)-3-furanyl]-N'-(1,1-dimethylethyl)-
Alternate Name(s) 4-(N'-t-butylureido)-5,5-dimethyl-3-phenylsulfinyl-2(5H)-furanone N-(tert-butyl)-N'-[2,2-dimethyl-5-oxo-4-(phenylsulfinyl)-2,5-dihydro-3-furanyl]urea
CAS Registry Number 112890-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O4S
InChI InChI=1S/C17H22N2O4S/c1-16(2,3)19-15(21)18-13-12(14(20)23-17(13,4)5)24(22)11-9-7-6-8-10-11/h6-10H,1-5H3,(H2,18,19,21)
InChIKey COCLTMUPELRPJC-UHFFFAOYSA-N
Molecular Weight 350.433 g/mol
SMILES N(C1=C(C(OC1(C)C)=O)S(=O)c1ccccc1)C(NC(C)(C)C)=O
SPLASH splash10-0pbc-9110000000-92466a1d642fdedb04fd
Source of Spectrum AJ-60-2148-6
Wiley ID 1341816