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6-Anilino-2,2-dimethyl-4-oxo-3H-thiopyran-5-carboxylic acid ethyl ester
SpectraBase Compound ID GQp92lLgkjF
InChI InChI=1S/C16H19NO3S/c1-4-20-15(19)13-12(18)10-16(2,3)21-14(13)17-11-8-6-5-7-9-11/h5-9,17H,4,10H2,1-3H3
InChIKey GAJQCAMSNYVWBG-UHFFFAOYSA-N
Mol Weight 305.39 g/mol
Molecular Formula C16H19NO3S
Exact Mass 305.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5oG1ucPYmm
Name 6-Anilino-2,2-dimethyl-4-oxo-3H-thiopyran-5-carboxylic acid ethyl ester
CAS Registry Number 117535-85-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO3S
InChI InChI=1S/C16H19NO3S/c1-4-20-15(19)13-12(18)10-16(2,3)21-14(13)17-11-8-6-5-7-9-11/h5-9,17H,4,10H2,1-3H3
InChIKey GAJQCAMSNYVWBG-UHFFFAOYSA-N
Molecular Weight 305.392 g/mol
SMILES N(C1=C(C(=O)CC(S1)(C)C)C(=O)OCC)c1ccccc1
SPLASH splash10-0a4i-1497000000-546aefbc069eab13f578
Source of Spectrum Y-25-797-9
Synonyms 6-Anilino-4-keto-2,2-dimethyl-3H-thiopyran-5-carboxylic acid ethyl ester Ethyl 2,2-dimethyl-4-oxidanylidene-6-phenylazanyl-3H-thiopyran-5-carboxylate Ethyl 6-anilino-2,2-dimethyl-4-oxo-3H-thiopyran-5-carboxylate
Wiley ID 1307261