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Ethyl 2-[3-(2-cyano-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate

View entire compound with spectra: 1 MS (GC)

Ethyl 2-[3-(2-cyano-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate
SpectraBase Compound ID KrkPex3ScHn
InChI InChI=1S/C21H15N3O3/c1-2-27-21(26)16-10-4-3-8-15(16)9-7-13-24-19(14-22)23-18-12-6-5-11-17(18)20(24)25/h3-6,8,10-12H,2,13H2,1H3
InChIKey FZCBHLBKPAMGDL-UHFFFAOYSA-N
Mol Weight 357.37 g/mol
Molecular Formula C21H15N3O3
Exact Mass 357.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ykob6x2JtK
Name Ethyl 2-[3-(2-cyano-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15N3O3
InChI InChI=1S/C21H15N3O3/c1-2-27-21(26)16-10-4-3-8-15(16)9-7-13-24-19(14-22)23-18-12-6-5-11-17(18)20(24)25/h3-6,8,10-12H,2,13H2,1H3
InChIKey FZCBHLBKPAMGDL-UHFFFAOYSA-N
Molecular Weight 357.369 g/mol
SMILES C1(N(C(=Nc2ccccc12)C#N)CC#Cc1c(C(=O)OCC)cccc1)=O
SPLASH splash10-0pdi-1904000000-e5b04fa90fdbd81ad1c5
Source of Spectrum F-69-7070-4c
Synonyms Ethyl 2-(3-(2-cyano-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl)benzoate
Wiley ID 1738479