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4H-1-Benzothiopyran-4-one, 2-[4-(diethylamino)phenyl]-, 1,1-dioxide
SpectraBase Compound ID DUfhWijJyRE
InChI InChI=1S/C19H19NO3S/c1-3-20(4-2)15-11-9-14(10-12-15)19-13-17(21)16-7-5-6-8-18(16)24(19,22)23/h5-13H,3-4H2,1-2H3
InChIKey IMGRIJLEERQWIX-UHFFFAOYSA-N
Mol Weight 341.43 g/mol
Molecular Formula C19H19NO3S
Exact Mass 341.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Z9D5y0yaVD
Name 4H-1-Benzothiopyran-4-one, 2-[4-(diethylamino)phenyl]-, 1,1-dioxide
Alternate Name(s) 2-(p-diethylaminophenyl)-4H-1-benzothiopyran-4-one 1,1-dioxide 2-[4-(diethylamino)phenyl]-4H-1-benzothiopyran-4-one 1,1-dioxide
CAS Registry Number 116884-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO3S
InChI InChI=1S/C19H19NO3S/c1-3-20(4-2)15-11-9-14(10-12-15)19-13-17(21)16-7-5-6-8-18(16)24(19,22)23/h5-13H,3-4H2,1-2H3
InChIKey IMGRIJLEERQWIX-UHFFFAOYSA-N
Molecular Weight 341.425 g/mol
SMILES C=1(S(c2c(C(C1)=O)cccc2)(=O)=O)c1ccc(cc1)N(CC)CC
SPLASH splash10-01tc-0039000000-616fea2cf57d05cec9c3
Source of Spectrum KC-1988-1832-3
Wiley ID 1335897