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N-(2,3,3a,4,7,7a-Hexahydro-2,5-dimethyl-1,3-dioxo-1H-isoindol-4-yl)-N-methyl-3-phenylpropiolamide
SpectraBase Compound ID 2UJXPEA48Gh
InChI InChI=1S/C20H20N2O3/c1-13-9-11-15-17(20(25)22(3)19(15)24)18(13)21(2)16(23)12-10-14-7-5-4-6-8-14/h4-9,15,17-18H,11H2,1-3H3
InChIKey ZBMSBDPTYJSHMY-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 CWMLYelEggq
Name N-(2,3,3a,4,7,7a-Hexahydro-2,5-dimethyl-1,3-dioxo-1H-isoindol-4-yl)-N-methyl-3-phenylpropiolamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-13-9-11-15-17(20(25)22(3)19(15)24)18(13)21(2)16(23)12-10-14-7-5-4-6-8-14/h4-9,15,17-18H,11H2,1-3H3
InChIKey ZBMSBDPTYJSHMY-UHFFFAOYSA-N
Molecular Weight 336.391 g/mol
SMILES C(C#Cc1ccccc1)(=O)N(C)C1C2C(N(C(C2CC=C1C)=O)C)=O
SPLASH splash10-0200-3904000000-1b149de7ef8f0fb41d60
Source of Spectrum KC-61-11338-2
Synonyms N-(2,5-dimethyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl)-N-methyl-3-phenyl-2-propynamide
Wiley ID 1631350