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N-[3-(4-isopropyl-5,5-dimethyl-1,3-dioxan-2-yl)phenyl]-3-keto-4H-1,4-benzoxazine-6-sulfonamide

View entire compound with spectra: 1 MS (GC)

N-[3-(4-isopropyl-5,5-dimethyl-1,3-dioxan-2-yl)phenyl]-3-keto-4H-1,4-benzoxazine-6-sulfonamide
SpectraBase Compound ID 1hAHTkUCtQ2
InChI InChI=1S/C23H28N2O6S/c1-14(2)21-23(3,4)13-30-22(31-21)15-6-5-7-16(10-15)25-32(27,28)17-8-9-19-18(11-17)24-20(26)12-29-19/h5-11,14,21-22,25H,12-13H2,1-4H3,(H,24,26)
InChIKey OOTVYPLDXJDINT-UHFFFAOYSA-N
Mol Weight 460.55 g/mol
Molecular Formula C23H28N2O6S
Exact Mass 460.166808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CL6OLo6BgJH
Name N-[3-(4-isopropyl-5,5-dimethyl-1,3-dioxan-2-yl)phenyl]-3-keto-4H-1,4-benzoxazine-6-sulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28N2O6S
InChI InChI=1S/C23H28N2O6S/c1-14(2)21-23(3,4)13-30-22(31-21)15-6-5-7-16(10-15)25-32(27,28)17-8-9-19-18(11-17)24-20(26)12-29-19/h5-11,14,21-22,25H,12-13H2,1-4H3,(H,24,26)
InChIKey OOTVYPLDXJDINT-UHFFFAOYSA-N
Molecular Weight 460.545 g/mol
SMILES N1C(COc2c1cc(S(=O)(Nc1cccc(c1)C1OCC(C(O1)C(C)C)(C)C)=O)cc2)=O
SPLASH splash10-05fu-9510000000-d4d7601a1938096d46bd
Synonyms N-[3-(4-isopropyl-5,5-dimethyl-1,3-dioxan-2-yl)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide N-[3-(5,5-dimethyl-4-propan-2-yl-1,3-dioxan-2-yl)phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide N-[3-(5,5-dimethyl-4-propan-2-yl-1,3-dioxan-2-yl)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide
Wiley ID 1512294