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2,3,3a,4,7,7a-Hexahydro-2-methyl-1,3-dioxo-1H-isoindol-4-yl 3-phenylpropiolate
SpectraBase Compound ID LLZ2riGi0MC
InChI InChI=1S/C18H15NO4/c1-19-17(21)13-8-5-9-14(16(13)18(19)22)23-15(20)11-10-12-6-3-2-4-7-12/h2-7,9,13-14,16H,8H2,1H3
InChIKey DVHQWPXHDUCYAZ-UHFFFAOYSA-N
Mol Weight 309.32 g/mol
Molecular Formula C18H15NO4
Exact Mass 309.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLl5W5763uD
Name 2,3,3a,4,7,7a-Hexahydro-2-methyl-1,3-dioxo-1H-isoindol-4-yl 3-phenylpropiolate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO4
InChI InChI=1S/C18H15NO4/c1-19-17(21)13-8-5-9-14(16(13)18(19)22)23-15(20)11-10-12-6-3-2-4-7-12/h2-7,9,13-14,16H,8H2,1H3
InChIKey DVHQWPXHDUCYAZ-UHFFFAOYSA-N
Molecular Weight 309.321 g/mol
SMILES C1(N(C(C2CC=CC(C12)OC(C#Cc1ccccc1)=O)=O)C)=O
SPLASH splash10-0ufr-9610000000-e2ddfd2a428a27709b10
Source of Spectrum KC-61-11342-13
Synonyms 2-Methyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl 3-phenyl-2-propynoate
Wiley ID 1631330