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2-(4-Chloro-benzyl)-8-ethoxy-1,3-dimethyl-2H-cyclohepta[c]pyrrol-4-one
SpectraBase Compound ID 4KOBlMC0fYA
InChI InChI=1S/C20H20ClNO2/c1-4-24-18-7-5-6-17(23)19-13(2)22(14(3)20(18)19)12-15-8-10-16(21)11-9-15/h5-11H,4,12H2,1-3H3
InChIKey PTQJXFLYSQXYEP-UHFFFAOYSA-N
Mol Weight 341.84 g/mol
Molecular Formula C20H20ClNO2
Exact Mass 341.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8idR8DpWCvY
Name 2-(4-Chloro-benzyl)-8-ethoxy-1,3-dimethyl-2H-cyclohepta[c]pyrrol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClNO2
InChI InChI=1S/C20H20ClNO2/c1-4-24-18-7-5-6-17(23)19-13(2)22(14(3)20(18)19)12-15-8-10-16(21)11-9-15/h5-11H,4,12H2,1-3H3
InChIKey PTQJXFLYSQXYEP-UHFFFAOYSA-N
Molecular Weight 341.838 g/mol
SMILES c12c(c(C)[n](c2C)Cc2ccc(cc2)Cl)C(C=CC=C1OCC)=O
SPLASH splash10-004i-2922000000-c98405e64be01cde253e
Synonyms 2-(4-Chlorobenzyl)-4-ethoxy-1,3-dimethyl-cyclohepta[c]pyrrol-8-one 2-(4-Chlorobenzyl)-8-ethoxy-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-one 2-[(4-chlorophenyl)methyl]-4-ethoxy-1,3-dimethyl-8-cyclohepta[c]pyrrolone 2-[(4-chlorophenyl)methyl]-4-ethoxy-1,3-dimethyl-cyclohepta[c]pyrrol-8-one
Wiley ID 1466635