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N-(2,3,3a,4,7,7a-Hexahydro-2,5,7-trimethyl-1,3-dioxo-1H-isoindol-4-yl)-3-phenylpropiolamide
SpectraBase Compound ID 1UP2SfdGb4f
InChI InChI=1S/C20H20N2O3/c1-12-11-13(2)18(17-16(12)19(24)22(3)20(17)25)21-15(23)10-9-14-7-5-4-6-8-14/h4-8,11-12,16-18H,1-3H3,(H,21,23)
InChIKey BNERCVKUPXFGNL-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdsnEgwzBdL
Name N-(2,3,3a,4,7,7a-Hexahydro-2,5,7-trimethyl-1,3-dioxo-1H-isoindol-4-yl)-3-phenylpropiolamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-12-11-13(2)18(17-16(12)19(24)22(3)20(17)25)21-15(23)10-9-14-7-5-4-6-8-14/h4-8,11-12,16-18H,1-3H3,(H,21,23)
InChIKey BNERCVKUPXFGNL-UHFFFAOYSA-N
Molecular Weight 336.391 g/mol
SMILES N(C(C#Cc1ccccc1)=O)C1C2C(N(C(C2C(C=C1C)C)=O)C)=O
SPLASH splash10-0a6r-0790000000-d9db3b4d137f51d5281e
Source of Spectrum KC-61-11339-6
Synonyms 3-Phenyl-N-(2,5,7-trimethyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)-2-propynamide
Wiley ID 1631343