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4-Ethyl-4-hydroxy-2-methyl-1,3(2H)-isoquinolinedione

View entire compound with spectra: 1 MS (GC)

4-Ethyl-4-hydroxy-2-methyl-1,3(2H)-isoquinolinedione
SpectraBase Compound ID LLtZfeyy9LU
InChI InChI=1S/C12H13NO3/c1-3-12(16)9-7-5-4-6-8(9)10(14)13(2)11(12)15/h4-7,16H,3H2,1-2H3
InChIKey SLWDDANBIBMXMX-UHFFFAOYSA-N
Mol Weight 219.24 g/mol
Molecular Formula C12H13NO3
Exact Mass 219.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZDDdaZY6mj
Name 4-Ethyl-4-hydroxy-2-methyl-1,3(2H)-isoquinolinedione
Alternate Name(s) 3-Ethyl-3-hydroxy-2-methyl-1,3(2H)-isoquinolinedione 4-Ethyl-4-hydroxy-2-methyl-1,3(2H,4H)-isoquinolinedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO3
InChI InChI=1S/C12H13NO3/c1-3-12(16)9-7-5-4-6-8(9)10(14)13(2)11(12)15/h4-7,16H,3H2,1-2H3
InChIKey SLWDDANBIBMXMX-UHFFFAOYSA-N
Molecular Weight 219.240 g/mol
SMILES OC1(C(N(C(c2c1cccc2)=O)C)=O)CC
SPLASH splash10-0006-0900000000-50a4f1f292a8c1eceafb
Source of Spectrum F-55-9197-15
Wiley ID 838721